data_2xnf_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 2xnf _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 398' ' ' LYS . . . . . 0.478 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.311 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . 0.418 HD11 ' N ' ' A' ' 399' ' ' LEU . 2.9 mp -102.03 134.52 45.12 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -174.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.77 124.72 27.76 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.03 -41.24 2.77 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.451 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 54.9 t90 -148.8 149.71 31.82 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -173.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.6 m -138.98 117.67 12.24 Favored 'General case' 0 C--N 1.275 -2.643 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.451 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -160.58 -172.46 27.87 Favored Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.8 t -108.98 142.11 22.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -175.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.447 ' HG ' ' SG ' ' A' ' 429' ' ' CYS . 86.0 mt -113.12 141.46 46.88 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . 0.482 ' OE2' ' HG2' ' A' ' 447' ' ' LYS . 35.8 mt-10 -116.04 125.18 52.1 Favored 'General case' 0 N--CA 1.405 -2.688 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 174.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 64.9 p-90 . . . . . 0 N--CA 1.425 -1.692 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.452 -173.706 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 . . . . . 0 CA--C 1.499 -0.999 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 27.7 p -108.89 144.84 36.28 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 123.635 0.584 . . . . 0.0 110.987 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 20.9 tp -146.97 126.89 6.7 Favored Pre-proline 0 C--N 1.305 -1.363 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.97 142.05 24.59 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.396 2.064 . . . . 0.0 112.17 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . 0.447 ' SG ' ' HG ' ' A' ' 406' ' ' LEU . 26.0 p -144.29 163.49 33.56 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.376 0.608 . . . . 0.0 111.78 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -117.25 129.18 55.75 Favored 'General case' 0 N--CA 1.423 -1.792 0 N-CA-C 104.404 -2.443 . . . . 0.0 104.404 174.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 48.0 t -117.17 125.29 73.86 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.973 0 CA-C-O 121.794 0.807 . . . . 0.0 110.384 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -108.04 160.98 15.37 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 30.5 m -121.25 141.29 42.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.588 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 53.8 t30 -94.1 131.31 39.75 Favored 'General case' 1 C--O 1.359 6.855 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 173.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -38.43 148.1 0.05 OUTLIER 'General case' 0 C--N 1.363 1.161 3 O-C-N 130.865 5.103 . . . . 0.0 118.987 -161.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.51 -18.44 35.34 Favored Glycine 0 CA--C 1.494 -1.273 0 CA-C-N 112.528 -2.124 . . . . 0.0 110.858 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.565 ' OE2' ' HA ' ' A' ' 469' ' ' ARG . 5.6 mm-40 -98.07 118.0 33.69 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 114.329 -0.936 . . . . 0.0 110.806 -170.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -108.73 108.45 19.28 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -138.23 156.02 48.08 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -102.39 121.38 42.21 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-O 121.316 0.579 . . . . 0.0 111.034 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -88.71 -13.59 39.29 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.96 -19.01 65.72 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.567 0.699 . . . . 0.0 109.626 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -82.1 -10.87 59.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.448 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -84.0 141.76 40.99 Favored Pre-proline 0 C--O 1.245 0.864 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -67.31 163.18 35.48 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.567 2.178 . . . . 0.0 109.799 171.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -81.84 -9.93 59.47 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.482 ' HG2' ' OE2' ' A' ' 407' ' ' GLU . 1.8 mptm? -124.47 135.99 53.67 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.915 172.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 56.3 mt -118.5 146.69 44.33 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 59.1 mt -98.82 116.93 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.42 ' HA ' ' O ' ' A' ' 497' ' ' CYS . 22.5 ptm -122.87 134.32 54.39 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.429 0.633 . . . . 0.0 112.186 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -116.71 133.82 55.55 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.52 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -81.58 110.37 16.89 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.296 0.569 . . . . 0.0 110.013 177.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 2.4 pp -118.4 152.95 51.59 Favored Pre-proline 0 C--N 1.301 -1.519 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.713 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.96 128.69 20.24 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 121.032 1.155 . . . . 0.0 113.159 -177.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.27 -25.88 68.52 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.137 1.375 . . . . 0.0 110.595 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -57.28 -41.16 79.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.461 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 8.3 mp -85.88 -8.89 57.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.984 0.421 . . . . 0.0 111.219 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.49 -20.0 55.01 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.201 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 11.4 m -57.52 -28.72 63.74 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.015 0.926 . . . . 0.0 110.489 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.55 -22.42 65.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.094 -177.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.59 9.64 42.8 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.653 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -42.7 -55.89 4.49 Favored Glycine 0 CA--C 1.543 1.835 0 N-CA-C 116.31 1.284 . . . . 0.0 116.31 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.75 -19.79 59.22 Favored 'Trans proline' 0 C--N 1.362 1.289 0 CA-C-N 120.122 1.961 . . . . 0.0 113.17 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.22 -22.37 55.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.358 0.599 . . . . 0.0 109.997 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.0 -13.54 61.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.957 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -72.61 -9.87 59.12 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.53 81.29 1.88 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.155 0.978 . . . . 0.0 110.164 173.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' SER . . . . . 0.413 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 51.8 m -155.35 169.42 24.26 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.239 -175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.565 ' HA ' ' OE2' ' A' ' 437' ' ' GLU . 0.1 OUTLIER -109.79 141.72 42.04 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -176.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.588 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 41.1 mtp -97.7 149.04 22.72 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 113.593 -3.243 . . . . 0.0 111.347 -172.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 11.6 m -135.17 160.58 40.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.371 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -139.77 133.62 30.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.452 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 65.2 m-85 -107.95 125.3 51.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-O 121.628 0.728 . . . . 0.0 110.748 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -121.32 123.2 41.59 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 . . . . . 0 C--N 1.287 -2.139 0 C-N-CA 119.535 -0.866 . . . . 0.0 113.075 -174.579 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 85.0 mt . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -65.6 -40.64 92.9 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.622 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.8 m -66.54 -41.42 88.74 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.36 -48.18 80.92 Favored 'General case' 0 C--O 1.201 -1.495 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.777 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 37.5 ttpt -55.35 -47.03 76.34 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 123.517 0.727 . . . . 0.0 110.868 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -63.24 -43.23 98.84 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . 0.475 HD22 ' SD ' ' A' ' 490' ' ' MET . 9.5 tt -66.28 -38.58 88.11 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 123.19 0.596 . . . . 0.0 110.91 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -56.55 -41.39 76.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.172 0.589 . . . . 0.0 110.714 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 484' ' ' LYS . 24.8 mmt180 -60.97 -47.26 87.28 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 75.9 mt -68.44 -52.8 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.981 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' MET . . . . . 0.475 ' SD ' HD22 ' A' ' 486' ' ' LEU . 87.3 mtp -76.18 -23.1 54.7 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.046 -0.662 . . . . 0.0 112.184 -175.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -81.41 -12.1 82.41 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.085 -0.578 . . . . 0.0 111.737 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -92.75 3.8 54.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.67 0.748 . . . . 0.0 110.008 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.93 30.15 6.54 Favored Glycine 0 N--CA 1.435 -1.4 0 C-N-CA 119.63 -1.271 . . . . 0.0 113.159 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -104.71 141.0 37.24 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 170.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . 0.401 ' HB3' ' SD ' ' A' ' 512' ' ' MET . . . -118.54 147.91 43.19 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -178.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -104.12 104.88 2.51 Favored Glycine 0 N--CA 1.421 -2.352 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . 0.451 ' SG ' HG13 ' A' ' 537' ' ' ILE . 42.1 t -82.88 119.83 24.89 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.5 t -101.25 121.17 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.645 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -109.01 137.94 46.13 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . 0.458 ' HD2' ' O ' ' A' ' 509' ' ' ARG . 95.5 m-85 -92.49 133.82 29.05 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo . . . . . 0 C--O 1.25 1.087 0 C-N-CA 122.156 1.904 . . . . 0.0 110.604 172.426 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 31.6 t . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.458 ' O ' ' HD2' ' A' ' 500' ' ' PHE . 96.8 mtt180 -169.76 -176.95 2.52 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.193 -3.262 . . . . 0.0 102.193 -174.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.572 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.8 m -134.93 155.97 39.04 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.749 0 CA-C-N 120.832 1.651 . . . . 0.0 111.235 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 40.6 tp -125.52 148.84 48.74 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-O 120.899 0.38 . . . . 0.0 111.609 -172.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' MET . . . . . 0.407 ' O ' ' HA2' ' A' ' 524' ' ' GLY . 39.0 tpp -113.78 138.76 49.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 175.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . 0.434 HD21 ' HE2' ' A' ' 490' ' ' MET . 0.9 OUTLIER -117.5 124.84 49.73 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.072 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.41 139.81 50.59 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 123.605 0.762 . . . . 0.0 109.588 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -94.27 122.94 37.33 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.926 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.9 p -105.83 110.62 22.98 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 12.4 m -68.45 -32.11 71.89 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.391 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -63.24 -41.52 99.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.845 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -94.09 -5.91 46.25 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.9 tptt 62.55 21.36 12.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.402 1.481 . . . . 0.0 110.512 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.06 167.77 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.868 -173.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . 0.452 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 61.3 m-85 -96.46 139.41 32.6 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -128.39 165.9 19.72 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 512' ' ' MET . . . -178.39 153.7 13.32 Favored Glycine 0 N--CA 1.426 -2.01 0 C-N-CA 119.353 -1.403 . . . . 0.0 112.545 175.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.465 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 8.5 mp -115.19 140.04 49.42 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 122.344 0.258 . . . . 0.0 110.429 174.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 510' ' ' VAL . 3.0 tt -109.21 108.11 60.12 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-O 120.899 0.381 . . . . 0.0 111.903 177.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 31.8 Cg_exo -69.86 140.35 42.1 Favored 'Trans proline' 0 C--O 1.283 2.766 0 C-N-CA 123.637 2.891 . . . . 0.0 112.764 171.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -70.64 -44.78 66.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 113.555 -1.657 . . . . 0.0 110.316 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -85.16 101.88 12.83 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.575 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -31.98 72.59 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.956 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 18.5 m -59.3 -48.3 82.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.8 -40.36 37.01 Favored Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.179 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.491 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 34.3 t80 -70.59 -46.82 62.7 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.647 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.97 -38.89 81.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -57.54 -46.07 84.31 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.461 0.304 . . . . 0.0 110.352 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . 0.402 ' O ' HG22 ' A' ' 540' ' ' VAL . . . -64.6 -42.05 97.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.644 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.473 ' O ' HG13 ' A' ' 541' ' ' ILE . 48.2 mm -66.88 -35.82 75.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 122.12 0.168 . . . . 0.0 110.945 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.1 -41.35 75.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.956 0.503 . . . . 0.0 110.144 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -63.0 -45.82 90.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.655 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 536' ' ' GLY . 55.7 t -62.4 -45.9 97.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.34 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 537' ' ' ILE . 66.7 mt -65.44 -45.43 92.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 C-N-CA 122.343 0.257 . . . . 0.0 111.42 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.6 t -67.22 -35.73 80.2 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.949 -178.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -67.73 -42.16 82.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.195 0.521 . . . . 0.0 109.787 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 46.0 tp . . . . . 0 C--O 1.211 -0.935 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.67 -178.818 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . 0.497 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.346 0 CA-C-O 120.871 0.367 . . . . 0.0 110.028 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.94 118.48 36.92 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.281 -175.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.53 126.36 27.62 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 176.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -132.55 -46.0 0.89 Allowed 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.446 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 61.4 t90 -147.81 143.42 27.47 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.376 -176.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 43.8 t -127.44 118.05 23.31 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.446 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -163.07 -172.51 30.65 Favored Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.968 -175.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 53.3 t -113.28 141.4 29.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.304 0.642 . . . . 0.0 109.354 -176.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.549 HD12 ' SG ' ' A' ' 429' ' ' CYS . 10.9 mp -114.08 140.54 48.39 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 69.0 mt-10 -115.61 126.05 53.7 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.606 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 . . . . . 0 C--N 1.287 -2.142 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.483 -178.481 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 15.4 mmm180 . . . . . 0 N--CA 1.426 -1.628 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 426' ' ' SER . . . . . 0.475 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 5.4 p -122.42 133.39 54.62 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.259 0.349 . . . . 0.0 110.825 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 95.0 mt -133.54 126.22 19.0 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.191 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.62 135.2 14.35 Favored 'Trans proline' 0 C--O 1.249 1.053 0 C-N-CA 122.263 1.975 . . . . 0.0 110.941 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . 0.566 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 20.8 p -143.21 167.02 23.1 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.336 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -117.13 129.64 56.1 Favored 'General case' 0 N--CA 1.413 -2.29 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 47.7 t -112.16 122.61 66.76 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-O 122.431 1.11 . . . . 0.0 109.958 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -108.72 160.22 16.13 Favored 'General case' 0 N--CA 1.397 -3.078 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 25.8 m -120.87 140.75 44.04 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.026 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.269 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.464 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 25.7 t-20 -95.72 131.03 42.43 Favored 'General case' 1 C--O 1.326 5.094 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.712 179.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -27.56 131.51 0.04 OUTLIER 'General case' 0 C--O 1.244 0.808 0 O-C-N 127.288 2.867 . . . . 0.0 113.576 -170.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 111.02 -3.11 28.56 Favored Glycine 0 N--CA 1.421 -2.302 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 -173.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.481 ' OE1' ' HB2' ' A' ' 469' ' ' ARG . 12.7 tt0 -115.87 111.89 21.12 Favored 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 173.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -136.44 97.68 3.64 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -139.19 157.88 45.15 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . 0.42 ' C ' ' H ' ' A' ' 442' ' ' GLU . 52.4 tttm -90.42 108.0 19.5 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -74.43 31.42 0.09 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.382 1.073 . . . . 0.0 112.973 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . 0.42 ' H ' ' C ' ' A' ' 440' ' ' LYS . 36.5 tt0 -66.98 -46.83 73.43 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.628 1.171 . . . . 0.0 112.721 -174.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -92.88 15.23 15.28 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.876 0.37 . . . . 0.0 111.452 -176.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 8.4 m0 -76.79 129.53 78.78 Favored Pre-proline 0 C--N 1.311 -1.072 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.74 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -70.96 163.54 38.88 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.45 2.1 . . . . 0.0 109.762 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -85.68 -6.08 59.18 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 93.8 mttt -127.73 132.79 49.55 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.5 mt -118.8 146.19 45.02 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.214 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.3 128.24 55.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 80.6 mtp -100.75 125.39 47.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.262 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -107.97 113.54 26.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 7.9 mp -85.35 124.74 32.31 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.246 0.546 . . . . 0.0 111.587 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.5 pt -134.5 161.04 66.08 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.456 -177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -72.04 128.68 14.26 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 120.064 1.059 . . . . 0.0 112.518 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -63.7 -30.36 71.47 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.623 1.169 . . . . 0.0 110.553 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.08 -36.13 82.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.892 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 34.1 tp -87.29 -5.55 58.88 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.632 0.73 . . . . 0.0 111.022 -176.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 59.1 tp -78.01 -16.12 58.36 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.791 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 22.5 p -57.59 -29.21 64.28 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 124.101 0.96 . . . . 0.0 113.101 -174.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 21.4 m -63.18 -29.75 71.04 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-O 121.102 0.477 . . . . 0.0 110.757 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.14 7.92 29.36 Favored 'General case' 0 C--O 1.222 -0.391 0 O-C-N 122.193 -0.317 . . . . 0.0 111.55 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -46.1 -58.03 5.91 Favored Glycine 0 CA--C 1.543 1.792 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.9 -22.84 75.49 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 122.672 2.248 . . . . 0.0 113.336 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.8 tp -72.43 -29.87 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.016 0.436 . . . . 0.0 109.899 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -75.22 -13.19 60.43 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.297 -0.865 . . . . 0.0 113.073 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . 0.451 ' NE ' ' HA ' ' A' ' 466' ' ' ARG . 5.0 mmp_? -61.78 -46.2 90.6 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.106 -0.638 . . . . 0.0 111.946 -177.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -95.13 84.29 4.06 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.0 m -148.24 169.99 18.86 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.922 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.481 ' HB2' ' OE1' ' A' ' 437' ' ' GLU . 8.0 mtm180 -111.13 141.98 43.92 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 -175.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.512 ' HG2' ' HG ' ' A' ' 525' ' ' LEU . 47.5 mtp -99.73 152.71 19.79 Favored 'General case' 0 N--CA 1.425 -1.717 0 C-N-CA 116.837 -1.945 . . . . 0.0 110.75 -173.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 23.1 m -134.0 159.45 42.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.661 178.031 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -129.44 119.87 24.52 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.752 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -107.42 119.87 40.61 Favored 'General case' 0 C--O 1.29 3.199 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.296 -177.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.23 123.22 27.97 Favored 'General case' 0 N--CA 1.42 -1.96 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 174.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 41.2 m-85 . . . . . 0 C--N 1.292 -1.916 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.002 -176.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 484' ' ' LYS . 20.0 mt . . . . . 0 N--CA 1.444 -0.737 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -72.23 -53.79 11.53 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.035 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 7.0 m -73.88 -47.94 34.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -172.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . 0.501 ' HB3' ' CE2' ' A' ' 487' ' ' TYR . 30.4 mt -71.07 -22.39 62.12 Favored 'General case' 0 C--O 1.19 -2.029 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -174.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.508 ' HB3' ' HZ2' ' A' ' 484' ' ' LYS . 6.4 ttpm? -55.81 -42.65 75.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 175.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -70.0 -44.5 61.07 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.13 175.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -41.67 97.23 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 483' ' ' LEU . 7.0 m-30 -56.23 -42.36 77.14 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.393 0.677 . . . . 0.0 109.774 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.29 -48.05 79.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.197 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 68.6 mt -62.2 -50.54 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 123.577 0.548 . . . . 0.0 111.341 -178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 91.6 mmm -63.65 -43.01 98.02 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.363 0.601 . . . . 0.0 110.427 -177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -70.34 -12.8 69.88 Favored Glycine 0 CA--C 1.521 0.464 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.685 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -88.5 11.04 18.18 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.287 1.041 . . . . 0.0 109.201 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.91 30.07 6.94 Favored Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.106 177.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -113.38 145.16 41.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 117.098 0.449 . . . . 0.0 111.367 176.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -124.46 153.47 41.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -114.16 107.39 1.85 Allowed Glycine 0 N--CA 1.422 -2.24 0 C-N-CA 120.34 -0.933 . . . . 0.0 111.204 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 49.5 t -82.42 121.04 26.21 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.0 t -100.8 120.8 50.79 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.197 0 CA-C-O 121.687 0.756 . . . . 0.0 109.588 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -107.6 143.23 36.35 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.84 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -100.19 129.26 28.57 Favored Pre-proline 0 C--N 1.284 -2.268 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.61 -176.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo . . . . . 0 C--O 1.245 0.858 0 N-CA-C 107.19 -1.889 . . . . 0.0 107.19 169.175 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p . . . . . 0 N--CA 1.434 -1.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.443 ' HG2' ' HA ' ' A' ' 528' ' ' TYR . 4.7 mtm180 72.69 165.47 0.29 Allowed 'General case' 0 C--N 1.373 1.612 0 C-N-CA 124.853 1.261 . . . . 0.0 109.071 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.552 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 15.9 m -128.63 163.92 32.0 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.945 0 C-N-CA 117.766 -1.574 . . . . 0.0 111.404 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.545 ' HB2' HG12 ' A' ' 526' ' ' ILE . 12.3 tp -125.88 145.87 50.07 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.279 0.561 . . . . 0.0 112.346 -173.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 38.5 tpp -115.24 117.81 31.55 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 48.3 tp -100.03 121.17 40.96 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 121.239 0.542 . . . . 0.0 109.995 -178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.17 130.02 51.81 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.45 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -90.13 127.45 36.1 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.8 p -101.46 110.76 22.81 Favored 'General case' 0 N--CA 1.401 -2.876 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 7.9 m -68.5 -34.36 75.76 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.197 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -74.46 -27.9 60.8 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.743 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -99.0 -9.89 23.37 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 120.461 -0.496 . . . . 0.0 109.861 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 59.74 31.01 20.59 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.467 1.107 . . . . 0.0 111.797 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -144.82 167.48 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -176.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -102.56 138.33 39.61 Favored 'General case' 0 N--CA 1.42 -1.936 0 C-N-CA 119.321 -0.952 . . . . 0.0 110.283 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 25.8 ptm -127.01 159.57 33.73 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -165.89 153.08 22.79 Favored Glycine 0 N--CA 1.42 -2.38 0 C-N-CA 118.437 -1.839 . . . . 0.0 112.67 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.512 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 9.6 mp -115.58 139.21 50.3 Favored 'General case' 0 C--N 1.29 -1.987 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 171.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.545 HG12 ' HB2' ' A' ' 511' ' ' LEU . 25.0 mt -105.67 107.46 59.41 Favored Pre-proline 0 N--CA 1.428 -1.558 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.552 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 25.4 Cg_exo -70.93 138.0 33.2 Favored 'Trans proline' 0 C--O 1.295 3.359 0 C-N-CA 123.027 2.485 . . . . 0.0 112.316 171.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . 0.443 ' HA ' ' HG2' ' A' ' 509' ' ' ARG . 96.9 m-85 -71.65 -41.43 68.79 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 113.3 -1.773 . . . . 0.0 110.28 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.48 89.71 3.84 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -67.5 -44.98 77.18 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.71 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.1 m -60.36 -46.85 88.47 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 112.818 0.674 . . . . 0.0 112.818 -174.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -75.85 -38.48 36.18 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.453 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.53 ' O ' HG12 ' A' ' 537' ' ' ILE . 46.4 t80 -63.98 -47.57 79.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 93.5 t -61.45 -38.85 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 121.09 0.471 . . . . 0.0 110.038 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -62.44 -41.18 98.55 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.352 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.99 -41.15 93.37 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 533' ' ' PHE . 46.7 mm -62.72 -35.52 71.05 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 122.757 0.423 . . . . 0.0 111.122 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -55.92 -38.59 70.46 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.05 0.452 . . . . 0.0 111.301 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -68.99 -44.27 73.2 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.301 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 48.6 t -62.39 -42.26 94.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.176 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 537' ' ' ILE . 73.8 mt -60.54 -45.14 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.328 0.651 . . . . 0.0 109.708 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 60.2 m -58.7 -41.53 86.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.112 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -68.11 -42.93 79.53 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.455 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 N--CA 1.469 0.511 0 C-N-CA 123.659 0.784 . . . . 0.0 111.726 -179.288 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . 0.475 ' HD2' ' N ' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.493 -1.249 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.16 132.47 52.19 Favored 'General case' 0 C--N 1.265 -3.091 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -175.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.58 128.87 37.59 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -118.59 -62.88 1.48 Allowed 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.468 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 52.1 t90 -140.11 145.95 38.25 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.357 -171.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 20.6 t -126.26 121.52 32.91 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.468 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -169.56 -172.09 35.82 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.443 -175.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . 0.411 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 49.7 t -109.55 139.23 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.411 HD11 ' HB2' ' A' ' 448' ' ' LEU . 9.2 tp -113.91 132.2 56.01 Favored 'General case' 0 N--CA 1.409 -2.514 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -115.62 125.85 53.44 Favored 'General case' 0 N--CA 1.419 -2.012 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 . . . . . 0 C--N 1.296 -1.745 0 CA-C-O 121.04 0.447 . . . . 0.0 111.143 -171.688 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 . . . . . 0 C--O 1.211 -0.931 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 46.9 p -125.46 131.53 52.84 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.926 0.393 . . . . 0.0 111.484 -175.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . 0.438 HD23 ' HB3' ' A' ' 482' ' ' SER . 62.1 mt -136.16 127.38 16.94 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 122.754 0.422 . . . . 0.0 111.977 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -73.43 134.47 20.74 Favored 'Trans proline' 0 C--O 1.254 1.312 0 C-N-CA 122.385 2.056 . . . . 0.0 110.791 175.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.3 p -141.91 161.54 37.71 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.694 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -116.98 129.78 56.26 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.36 124.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.795 0 CA-C-O 121.739 0.78 . . . . 0.0 110.502 -175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -107.86 155.37 20.35 Favored 'General case' 0 C--N 1.28 -2.428 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 18.1 m -122.27 139.31 49.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 37.0 t30 -98.33 130.86 45.0 Favored 'General case' 1 C--O 1.309 4.219 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.502 168.703 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -19.53 152.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 131.166 3.786 . . . . 0.0 118.201 -170.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 110.76 -1.16 28.89 Favored Glycine 0 C--O 1.244 0.769 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.488 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 437' ' ' GLU . 0.0 OUTLIER -97.19 146.31 25.2 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -174.063 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -155.95 93.41 1.44 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 160.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -142.26 146.4 35.09 Favored 'General case' 0 C--N 1.281 -2.385 0 CA-C-N 114.09 -1.413 . . . . 0.0 107.539 174.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 19.4 ptmt -102.25 129.41 48.64 Favored 'General case' 0 C--N 1.282 -2.359 0 C-N-CA 118.665 -1.214 . . . . 0.0 110.185 175.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.0 p -83.56 1.15 43.46 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.086 0.946 . . . . 0.0 111.435 -175.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.08 -30.12 71.21 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.687 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 440' ' ' LYS . 4.4 pt20 -101.29 17.22 23.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.627 -176.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -95.94 141.84 23.73 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.257 177.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.85 163.04 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.187 1.925 . . . . 0.0 109.74 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . 0.308 2.7 pp0? -97.55 -7.78 30.54 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 14.0 mptt -127.88 113.77 16.33 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.786 0.834 . . . . 0.0 109.67 169.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . 0.411 ' HB2' HD11 ' A' ' 406' ' ' LEU . 50.3 mt -103.38 147.12 27.5 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 46.5 mm -99.35 122.52 51.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 120.887 0.375 . . . . 0.0 110.543 -174.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.418 ' SD ' HD21 ' A' ' 513' ' ' LEU . 57.9 ttp -112.08 121.82 46.04 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . 0.441 ' HB2' ' SG ' ' A' ' 497' ' ' CYS . 12.4 mm-40 -106.91 133.62 51.29 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -91.29 115.87 28.37 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.473 0.654 . . . . 0.0 111.391 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 39.6 pt -116.9 161.76 30.79 Favored Pre-proline 0 C--N 1.311 -1.077 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.078 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -71.54 129.68 16.09 Favored 'Trans proline' 0 C--O 1.244 0.806 0 C-N-CA 121.464 1.443 . . . . 0.0 110.919 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -62.75 -28.15 69.77 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.5 0.72 . . . . 0.0 111.148 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 -63.89 -40.7 97.13 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.132 -176.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.8 mt -77.81 -11.47 59.89 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.198 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.1 tp -82.69 -19.33 38.32 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.0 m -58.28 -28.55 65.06 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 122.959 0.503 . . . . 0.0 111.134 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 15.7 m -61.37 -27.62 68.65 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.195 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.07 8.42 37.86 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.628 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . 0.424 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -45.96 -52.25 10.08 Favored Glycine 0 CA--C 1.545 1.933 0 N-CA-C 114.891 0.716 . . . . 0.0 114.891 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 11.8 Cg_endo -56.14 -28.62 71.3 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.88 2.387 . . . . 0.0 113.405 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 42.4 tp -75.93 -29.89 58.53 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.202 0.525 . . . . 0.0 110.762 -177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -72.99 -12.61 61.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.183 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -68.83 -20.48 64.31 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.777 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -127.21 84.66 2.28 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.334 0.588 . . . . 0.0 109.482 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.4 m -158.15 170.32 22.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 -178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -110.45 143.75 40.28 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 124.326 1.051 . . . . 0.0 109.61 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.491 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 32.2 mmm -96.39 152.06 18.95 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -165.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 4.8 m -142.27 162.08 19.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -133.84 130.03 37.32 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -110.95 117.62 33.87 Favored 'General case' 0 C--O 1.274 2.389 0 CA-C-O 121.734 0.778 . . . . 0.0 111.015 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -114.51 122.71 47.4 Favored 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 173.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 C--N 1.288 -2.073 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.66 -177.462 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 79.1 mt . . . . . 0 C--O 1.214 -0.804 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -69.53 -42.33 74.79 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.275 0.559 . . . . 0.0 110.865 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' SER . . . . . 0.438 ' HB3' HD23 ' A' ' 427' ' ' LEU . 8.5 t -72.22 -38.35 69.0 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.76 -43.78 97.89 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.276 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -55.04 -43.04 73.4 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.312 0.645 . . . . 0.0 110.587 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.499 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.96 -46.44 59.49 Favored Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 42.4 tp -58.41 -44.3 88.96 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 123.544 0.737 . . . . 0.0 111.267 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -60.35 -40.33 90.34 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 122.654 0.382 . . . . 0.0 111.16 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -66.58 -44.04 83.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.018 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 485' ' ' GLY . 66.2 mt -65.78 -44.4 93.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.159 0.504 . . . . 0.0 109.834 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.4 mmt -63.87 -43.01 97.37 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.041 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.16 -15.36 69.74 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.215 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -84.72 -4.24 58.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.396 0.617 . . . . 0.0 109.891 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.56 30.42 6.54 Favored Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.104 -1.046 . . . . 0.0 113.739 177.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -103.4 161.75 13.58 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.64 0.257 . . . . 0.0 110.342 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -127.95 153.12 47.07 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -112.31 107.53 2.07 Favored Glycine 0 N--CA 1.424 -2.152 0 C-N-CA 120.203 -0.998 . . . . 0.0 112.4 -177.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 451' ' ' GLN . 17.6 p -84.44 117.32 23.57 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.13 120.41 50.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.881 0 CA-C-O 121.962 0.887 . . . . 0.0 109.303 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -112.81 143.24 44.39 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 113.145 -1.843 . . . . 0.0 107.763 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . 0.43 ' CD2' HG13 ' A' ' 508' ' ' VAL . 15.8 m-85 -98.68 126.48 38.81 Favored Pre-proline 0 C--N 1.268 -2.969 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo . . . . . 0 C--O 1.244 0.819 0 C-N-CA 122.536 2.157 . . . . 0.0 112.992 -177.176 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . 0.43 HG13 ' CD2' ' A' ' 500' ' ' PHE . 4.6 t . . . . . 0 N--CA 1.423 -1.82 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.609 ' HD2' ' O ' ' A' ' 528' ' ' TYR . 19.4 mmt180 -81.2 171.15 15.23 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.539 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 24.2 m -109.44 165.87 5.12 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.402 0 C-N-CA 117.966 -1.494 . . . . 0.0 112.077 -171.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.58 ' HB2' HG12 ' A' ' 526' ' ' ILE . 1.0 OUTLIER -133.01 134.42 44.42 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.118 -177.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' MET . . . . . 0.415 ' N ' HD21 ' A' ' 511' ' ' LEU . 35.0 tpp -102.46 121.36 42.19 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.011 -0.736 . . . . 0.0 109.011 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 522' ' ' PHE . 31.8 tp -106.95 125.29 50.81 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.622 0.725 . . . . 0.0 110.523 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 59.4 mt -124.28 148.83 47.12 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.237 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -100.04 124.0 44.92 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.359 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 34.8 p -93.9 110.42 22.09 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 173.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.8 p -68.92 -35.49 76.87 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.352 -1.294 . . . . 0.0 113.061 -175.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -72.92 -24.17 60.78 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.65 0.738 . . . . 0.0 110.327 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -105.24 -9.81 17.45 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.257 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 61.09 24.13 14.26 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.736 1.214 . . . . 0.0 111.598 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -133.0 167.65 26.17 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.687 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . 0.431 ' HB3' HD12 ' A' ' 513' ' ' LEU . 24.4 m-85 -102.31 138.87 38.68 Favored 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.314 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -133.81 141.63 47.53 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.433 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -152.69 159.12 28.27 Favored Glycine 0 N--CA 1.431 -1.663 0 C-N-CA 118.861 -1.637 . . . . 0.0 113.465 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.534 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.6 mp -115.6 139.96 49.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 173.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.58 HG12 ' HB2' ' A' ' 511' ' ' LEU . 12.4 mt -97.97 107.98 43.73 Favored Pre-proline 0 C--O 1.249 1.072 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 177.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.539 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.8 Cg_exo -72.06 133.13 20.85 Favored 'Trans proline' 0 C--O 1.294 3.301 0 C-N-CA 123.231 2.621 . . . . 0.0 112.289 171.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . 0.609 ' O ' ' HD2' ' A' ' 509' ' ' ARG . 70.4 m-85 -74.89 -41.3 60.02 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.571 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -84.03 91.95 7.75 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.944 0.878 . . . . 0.0 110.184 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -37.34 83.13 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 114.201 -1.363 . . . . 0.0 113.138 179.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 22.6 t -61.0 -47.71 85.21 Favored 'General case' 0 C--O 1.243 0.763 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -175.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.68 -36.54 37.22 Favored Glycine 0 N--CA 1.437 -1.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.818 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.45 ' O ' HG12 ' A' ' 537' ' ' ILE . 50.2 t80 -66.22 -47.34 74.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 88.2 t -65.24 -38.36 82.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.052 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -59.17 -38.56 80.06 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.38 0.61 . . . . 0.0 110.187 176.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -70.53 -46.3 48.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 533' ' ' PHE . 51.6 mm -67.33 -36.15 75.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -56.33 -43.19 78.8 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -59.64 -40.45 87.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.647 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 56.5 t -67.28 -46.56 83.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.066 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.439 ' O ' ' HB2' ' A' ' 544' ' ' LEU . 77.0 mt -62.71 -45.25 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-O 121.302 0.572 . . . . 0.0 109.935 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 21.8 m -63.37 -33.56 75.81 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.907 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -64.63 -44.08 91.66 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 173.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 541' ' ' ILE . 96.8 mt . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 123.486 0.714 . . . . 0.0 111.733 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . 0.464 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.18 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mp -112.6 137.05 51.42 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.59 125.14 22.92 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -111.9 -64.65 1.26 Allowed 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.09 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.576 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 69.1 t90 -161.61 150.09 15.53 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -169.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.5 m -129.47 117.82 21.13 Favored 'General case' 0 C--N 1.276 -2.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.576 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -155.1 -172.39 22.73 Favored Glycine 0 N--CA 1.424 -2.15 0 C-N-CA 119.752 -1.213 . . . . 0.0 113.152 -174.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 61.6 t -109.28 140.71 26.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 84.4 mt -113.26 128.14 56.38 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -117.21 126.08 52.2 Favored 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -177.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 . . . . . 0 C--N 1.309 -1.162 0 C-N-CA 123.36 0.664 . . . . 0.0 110.085 -174.343 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.443 -0.811 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 56.3 p -123.13 130.1 52.32 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 121.134 -0.226 . . . . 0.0 110.863 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 428' ' ' PRO . 92.5 mt -130.55 125.94 21.78 Favored Pre-proline 0 C--N 1.316 -0.861 0 O-C-N 123.192 0.308 . . . . 0.0 111.094 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 427' ' ' LEU . 8.7 Cg_exo -75.84 142.34 25.29 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.043 2.496 . . . . 0.0 112.182 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 475' ' ' PHE . 23.1 p -141.13 168.57 19.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.2 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -115.7 129.53 56.51 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 104.953 -2.239 . . . . 0.0 104.953 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.8 t -122.79 123.92 69.33 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 CA-C-O 121.874 0.845 . . . . 0.0 110.274 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 472' ' ' GLN . 78.0 m-85 -118.54 161.0 20.75 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 6.2 m -121.86 140.22 46.5 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.501 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -96.07 132.96 40.9 Favored 'General case' 0 C--O 1.297 3.553 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.267 172.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -25.15 157.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 129.94 3.296 . . . . 0.0 117.385 -171.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.08 -2.43 35.34 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -172.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -101.77 161.46 13.64 Favored 'General case' 0 N--CA 1.406 -2.648 0 CA-C-N 113.12 -1.54 . . . . 0.0 114.584 -174.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 178.81 94.01 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 168.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -142.72 157.56 44.53 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.919 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -99.71 132.0 45.33 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' THR . . . . . 0.402 ' HA ' ' CD1' ' A' ' 444' ' ' TRP . 17.7 p -101.74 19.11 18.79 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.235 0.54 . . . . 0.0 111.965 -177.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -75.8 -27.53 57.98 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.511 0.672 . . . . 0.0 111.609 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -94.57 8.43 42.28 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.33 1.062 . . . . 0.0 109.855 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . 0.402 ' CD1' ' HA ' ' A' ' 441' ' ' THR . 12.7 m0 -80.18 121.1 81.46 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.468 177.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.98 149.47 70.46 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.55 2.167 . . . . 0.0 110.194 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.15 -22.53 59.4 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 123.066 0.546 . . . . 0.0 110.229 -174.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -124.35 123.84 41.08 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.555 173.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 90.2 mt -106.29 146.94 29.75 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 51.4 mm -98.53 119.12 46.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.506 ' SD ' HD21 ' A' ' 513' ' ' LEU . 54.2 ttp -113.33 129.7 56.46 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.347 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -119.0 130.93 55.94 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.54 123.71 30.6 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.233 -176.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 30.9 pt -128.61 158.03 73.24 Favored Pre-proline 0 C--N 1.305 -1.355 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.51 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -63.57 130.15 27.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 121.865 1.71 . . . . 0.0 111.312 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . 0.495 ' O ' ' HB3' ' A' ' 458' ' ' LEU . 21.1 tm0? -62.3 -29.93 70.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.249 0.62 . . . . 0.0 111.667 -177.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -60.27 -31.08 69.89 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -79.29 -12.75 59.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.218 0.533 . . . . 0.0 111.096 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 455' ' ' GLN . 4.2 tt -73.74 -22.18 59.96 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 124.036 0.934 . . . . 0.0 110.938 -178.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 41.7 p -58.42 -19.72 38.64 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 14.6 t -70.76 -21.14 62.55 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.279 0.561 . . . . 0.0 110.905 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 86.4 mt -88.62 11.05 18.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.127 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.19 -58.43 5.08 Favored Glycine 0 CA--C 1.548 2.115 0 CA-C-O 119.38 -0.678 . . . . 0.0 114.469 178.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.27 -24.44 78.85 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.899 2.4 . . . . 0.0 112.693 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.0 tp -75.46 -46.44 32.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.223 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -70.69 -14.77 62.58 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -71.95 -17.13 62.1 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.813 0.339 . . . . 0.0 111.054 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -126.78 76.83 1.67 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' SER . . . . . 0.41 ' HA ' ' CE2' ' A' ' 528' ' ' TYR . 69.3 m -152.8 170.99 18.96 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.926 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 437' ' ' GLU . 6.5 ptp180 -111.69 144.04 41.61 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 125.889 1.676 . . . . 0.0 109.039 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' MET . . . . . . . . . . . . . 27.3 mmm -95.4 152.61 18.24 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.405 -167.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.546 HG21 ' O ' ' A' ' 524' ' ' GLY . 16.8 m -127.14 162.08 32.91 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.275 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . 0.439 ' HB3' ' HB2' ' A' ' 432' ' ' TYR . 55.8 tp60 -133.51 119.95 20.19 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -115.36 126.44 54.43 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-O 121.594 0.711 . . . . 0.0 111.57 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.97 123.19 26.86 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 174.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . 0.401 ' HA ' ' HA ' ' A' ' 429' ' ' CYS . 56.4 m-85 . . . . . 0 C--N 1.294 -1.82 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.83 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 93.6 mt . . . . . 0 N--CA 1.446 -0.656 0 CA-C-O 120.983 0.42 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 484' ' ' LYS . 29.3 mm-40 -71.09 -45.02 64.51 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.9 m -63.87 -37.16 86.36 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.279 0.561 . . . . 0.0 109.527 176.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . 0.522 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 85.2 mt -64.57 -36.8 85.4 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.991 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 481' ' ' GLU . 36.9 ttpt -54.44 -44.49 72.53 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.715 0.806 . . . . 0.0 110.649 -178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -69.3 -43.52 70.13 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.092 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.88 -42.48 97.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.897 0.479 . . . . 0.0 110.081 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . 0.522 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -58.49 -40.41 82.69 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.689 0.396 . . . . 0.0 111.351 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -67.28 -37.68 83.83 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.2 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 65.6 mt -68.24 -45.58 82.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.1 mmt -63.62 -37.31 86.84 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.529 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.31 -9.95 84.35 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.344 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -92.53 8.52 38.49 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.774 0.797 . . . . 0.0 109.943 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 91.61 29.66 11.74 Favored Glycine 0 C--O 1.245 0.804 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.889 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -109.24 157.03 19.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -128.24 160.51 31.89 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -118.15 109.1 1.74 Allowed Glycine 0 N--CA 1.421 -2.319 0 C-N-CA 120.004 -1.094 . . . . 0.0 111.461 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 19.6 p -82.39 120.55 25.58 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.6 t -102.35 120.2 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.723 0 CA-C-O 121.489 0.661 . . . . 0.0 109.411 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -112.01 137.48 49.97 Favored 'General case' 0 N--CA 1.418 -2.044 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.783 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -98.95 114.81 65.83 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.535 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo . . . . . 0 N--CA 1.457 -0.662 0 C-N-CA 122.153 1.902 . . . . 0.0 108.593 175.998 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 33.6 t . . . . . 0 N--CA 1.431 -1.385 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.75 150.83 15.28 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 124.268 0.98 . . . . 0.0 110.389 -175.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 12.5 m -118.33 159.03 19.02 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.734 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 6.4 tt -135.35 147.11 48.99 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.119 -1.032 . . . . 0.0 112.747 -167.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 53.2 tpp -106.42 124.62 49.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . 0.506 HD21 ' SD ' ' A' ' 450' ' ' MET . 44.8 tp -104.17 127.31 51.76 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.536 0.684 . . . . 0.0 110.354 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -130.72 148.68 52.54 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.664 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -102.37 129.13 48.75 Favored 'General case' 0 C--N 1.277 -2.548 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 176.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.7 t -104.92 110.7 23.18 Favored 'General case' 0 N--CA 1.414 -2.246 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 11.7 t -69.73 -22.43 63.38 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.165 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -62.66 -43.38 98.96 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.945 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.02 -4.75 24.18 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.306 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 59.99 30.02 19.55 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.616 1.166 . . . . 0.0 111.492 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -140.96 168.71 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.948 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . 0.456 ' HB3' HD12 ' A' ' 513' ' ' LEU . 44.3 m-85 -96.41 139.26 32.78 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -138.05 166.51 23.92 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 123.689 0.796 . . . . 0.0 109.485 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.546 ' O ' HG21 ' A' ' 471' ' ' VAL . . . 178.86 167.29 36.25 Favored Glycine 0 N--CA 1.42 -2.369 0 C-N-CA 119.135 -1.507 . . . . 0.0 111.745 178.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.432 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.1 mp -114.94 140.66 48.83 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 170.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 510' ' ' VAL . 6.7 tt -103.38 107.86 57.22 Favored Pre-proline 0 C--N 1.299 -1.599 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.568 175.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.553 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 32.5 Cg_exo -66.33 132.21 28.81 Favored 'Trans proline' 0 C--O 1.282 2.689 0 C-N-CA 123.315 2.677 . . . . 0.0 113.286 172.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . 0.429 ' HE1' ' CZ ' ' A' ' 469' ' ' ARG . 43.3 m-85 -72.26 -38.98 68.73 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 113.175 -1.83 . . . . 0.0 109.094 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.35 87.29 6.6 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.428 -174.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.61 -34.53 78.1 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.741 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.8 p -58.92 -46.45 87.91 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.467 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.65 -34.76 52.98 Favored Glycine 0 N--CA 1.429 -1.774 0 CA-C-N 116.292 -0.413 . . . . 0.0 113.254 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.488 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 73.5 t80 -70.54 -47.64 59.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.295 0.548 . . . . 0.0 110.556 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 99.1 t -64.79 -37.82 81.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.002 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -59.54 -48.17 82.7 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.58 89.16 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.283 -0.484 . . . . 0.0 112.197 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.419 ' O ' HG13 ' A' ' 541' ' ' ILE . 39.9 mm -68.27 -22.15 27.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.619 -0.291 . . . . 0.0 111.326 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -60.58 -40.44 91.69 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.12 -0.363 . . . . 0.0 110.657 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.81 -38.02 89.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.94 -49.96 77.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.854 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 537' ' ' ILE . 81.8 mt -60.68 -45.96 96.66 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 123.18 0.592 . . . . 0.0 111.676 -178.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.7 t -65.93 -38.49 88.79 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.262 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.7 -41.4 79.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.246 176.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 CA--C 1.541 0.635 0 C-N-CA 122.92 0.488 . . . . 0.0 110.361 -178.701 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.434 -1.231 0 CA-C-O 121.094 0.473 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 4.3 mp -101.98 137.66 39.97 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.063 -175.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.25 115.45 7.72 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 175.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.66 -54.59 2.47 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.536 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 74.4 t90 -159.45 144.95 15.87 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.187 -171.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 45.7 m -130.0 120.89 25.49 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 174.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.536 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -156.48 -171.67 22.98 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -174.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -121.28 142.57 36.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-N 116.909 0.354 . . . . 0.0 110.148 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.654 HD12 ' SG ' ' A' ' 429' ' ' CYS . 9.8 mp -112.76 139.06 48.7 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -115.02 152.43 32.46 Favored 'General case' 0 C--O 1.254 1.34 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . 0.409 ' CD1' ' HE1' ' A' ' 450' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.443 0 C-N-CA 125.972 1.709 . . . . 0.0 108.997 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 . . . . . 0 N--CA 1.422 -1.872 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 57.5 p -144.48 159.76 42.22 Favored 'General case' 0 C--N 1.259 -3.357 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.208 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 22.6 tp -146.55 117.36 4.72 Favored Pre-proline 0 N--CA 1.412 -2.367 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.51 132.29 23.42 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.61 2.207 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . 0.654 ' SG ' HD12 ' A' ' 406' ' ' LEU . 0.0 OUTLIER -125.8 157.73 36.78 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.011 -175.515 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -116.89 128.92 55.71 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 170.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 28.5 t -120.33 122.98 69.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.899 0 CA-C-O 122.137 0.97 . . . . 0.0 110.218 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.09 155.09 26.61 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.464 HG11 HG11 ' A' ' 471' ' ' VAL . 26.2 m -122.33 140.74 45.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.405 0 C-N-CA 119.739 -0.785 . . . . 0.0 111.264 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 27.0 t-20 -95.2 132.24 40.37 Favored 'General case' 1 C--O 1.324 4.998 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.337 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -34.35 161.42 0.0 OUTLIER 'General case' 0 C--N 1.361 1.1 0 O-C-N 127.824 3.203 . . . . 0.0 116.66 -171.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 106.59 -3.01 36.61 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -174.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.65 161.9 13.34 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.601 1.16 . . . . 0.0 113.978 -174.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -165.25 95.66 0.67 Allowed 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 165.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -140.81 141.49 34.73 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.071 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -96.45 118.2 32.46 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 43.5 p -81.21 5.19 17.76 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.784 0.802 . . . . 0.0 111.099 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -59.04 -32.0 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.907 1.283 . . . . 0.0 109.943 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -90.81 4.58 51.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.297 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 18.4 m0 -92.78 126.25 52.43 Favored Pre-proline 0 C--N 1.308 -1.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.855 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.19 162.93 33.7 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.303 2.002 . . . . 0.0 110.474 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -75.58 -26.31 57.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 120.836 0.35 . . . . 0.0 111.044 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -113.98 130.95 56.49 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.666 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 39.4 mt -118.84 147.83 43.52 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.206 176.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 58.3 mt -98.33 123.64 50.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.409 ' HE1' ' CD1' ' A' ' 408' ' ' TRP . 65.8 ttp -100.47 132.54 45.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -124.25 115.91 21.81 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.55 116.25 26.66 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.328 0.585 . . . . 0.0 110.728 -177.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.0 pt -119.87 161.66 37.02 Favored Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 125.033 1.333 . . . . 0.0 108.52 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -67.48 129.58 20.46 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 121.393 1.395 . . . . 0.0 111.008 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -62.58 -36.59 83.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 123.789 0.836 . . . . 0.0 111.566 -174.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -66.35 -20.93 66.22 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.473 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.92 -3.92 59.13 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 122.144 -0.348 . . . . 0.0 111.507 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.5 tp -82.06 -16.23 50.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.201 0.524 . . . . 0.0 110.99 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 31.4 m -57.49 -25.68 60.15 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.068 0.947 . . . . 0.0 112.805 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 16.7 p -70.55 -18.97 62.93 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.763 -0.586 . . . . 0.0 111.795 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 92.9 mt -99.75 10.54 41.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.299 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -47.88 -54.98 10.43 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-O 119.399 -0.667 . . . . 0.0 114.038 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.98 -20.19 59.1 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 122.759 2.306 . . . . 0.0 113.272 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.81 -35.65 43.86 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -69.39 -13.06 62.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.323 0.649 . . . . 0.0 112.379 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -57.57 -30.46 65.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -127.02 97.12 4.83 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 75.1 m -156.46 172.1 19.12 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 123.66 0.784 . . . . 0.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 -109.42 142.06 40.94 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -175.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.49 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 71.0 mmm -96.37 142.43 28.5 Favored 'General case' 0 CA--C 1.492 -1.264 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.19 -168.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.464 HG11 HG11 ' A' ' 433' ' ' VAL . 4.9 m -131.59 153.56 38.98 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -132.08 127.04 35.24 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -111.47 125.9 54.38 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.347 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -130.04 127.77 40.6 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 172.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . 0.41 ' HB2' HD22 ' A' ' 483' ' ' LEU . 90.5 m-85 . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.4 mt . . . . . 0 C--O 1.211 -0.932 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -61.11 -51.28 69.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.027 0.205 . . . . 0.0 110.753 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 30.2 m -64.06 -36.67 84.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . 0.41 HD22 ' HB2' ' A' ' 475' ' ' PHE . 79.0 mt -69.1 -48.89 61.43 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.66 -45.41 73.85 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.293 1.037 . . . . 0.0 111.101 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.465 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.83 -44.92 66.76 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.57 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -62.66 -43.66 98.24 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -58.38 -42.48 87.16 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.244 0.618 . . . . 0.0 110.513 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -67.72 -44.62 77.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.96 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 485' ' ' GLY . 72.9 mt -64.44 -47.9 87.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 17.5 mmt -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.787 0.327 . . . . 0.0 111.086 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.04 -15.09 69.14 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.606 -178.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -85.46 2.5 44.34 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.687 0.795 . . . . 0.0 109.712 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.36 30.92 6.36 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 119.452 -1.356 . . . . 0.0 112.774 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -111.63 162.22 15.41 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 122.603 -0.351 . . . . 0.0 110.843 176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -133.73 158.84 42.28 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.48 107.17 1.32 Allowed Glycine 0 N--CA 1.422 -2.245 0 C-N-CA 119.968 -1.111 . . . . 0.0 112.074 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 38.7 t -85.91 121.52 28.66 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 73.2 t -102.21 120.57 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 122.078 0.942 . . . . 0.0 109.896 -177.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . 0.428 ' NE2' HG23 ' A' ' 534' ' ' VAL . 29.9 m80 -110.09 143.22 40.46 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.591 -178.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 510' ' ' VAL . 1.2 m-85 -99.03 141.73 23.39 Favored Pre-proline 0 C--N 1.266 -3.042 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -177.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo . . . . . 0 C--O 1.247 0.955 0 C-N-CA 121.85 1.7 . . . . 0.0 108.519 171.623 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.417 -2.123 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 528' ' ' TYR . 6.6 mpt_? -116.45 174.37 6.1 Favored 'General case' 0 C--N 1.281 -2.413 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.548 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.9 m -126.84 164.09 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 C-N-CA 118.687 -1.205 . . . . 0.0 108.266 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.412 ' HB3' HG12 ' A' ' 526' ' ' ILE . 1.3 pp -137.74 151.02 47.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 117.111 -1.836 . . . . 0.0 111.92 -175.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' MET . . . . . 0.478 ' O ' ' HA2' ' A' ' 524' ' ' GLY . 35.4 tpp -104.77 134.59 47.65 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 58.1 tp -119.39 120.34 36.61 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 123.399 0.68 . . . . 0.0 109.994 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 62.5 mt -129.03 146.12 51.08 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.301 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -99.09 123.57 43.48 Favored 'General case' 0 C--N 1.282 -2.361 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' SER . . . . . 0.429 ' OG ' ' HD3' ' A' ' 519' ' ' LYS . 38.3 t -99.24 111.16 23.6 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 174.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 40.5 m -67.83 -29.25 68.36 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.416 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -75.02 -40.41 60.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.322 0.582 . . . . 0.0 109.694 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . 0.429 ' HD3' ' OG ' ' A' ' 516' ' ' SER . 3.8 mptp? -85.83 -9.91 56.26 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.22 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.4 tptt 63.5 24.28 14.0 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.206 1.402 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.37 167.73 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.961 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -97.09 139.02 33.71 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 56.4 ttp -138.94 148.66 43.83 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.478 ' HA2' ' O ' ' A' ' 512' ' ' MET . . . -160.55 170.82 36.6 Favored Glycine 0 N--CA 1.421 -2.34 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.589 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.466 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.3 mp -115.59 139.98 49.6 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.412 HG12 ' HB3' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -103.59 108.08 58.25 Favored Pre-proline 0 C--N 1.298 -1.667 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.862 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.548 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 37.5 Cg_exo -69.07 133.6 27.26 Favored 'Trans proline' 0 C--O 1.295 3.327 0 C-N-CA 123.852 3.035 . . . . 0.0 114.504 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . 0.571 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 49.4 m-85 -65.68 -45.38 83.08 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 112.541 -2.118 . . . . 0.0 111.776 -176.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -99.51 119.09 37.47 Favored 'General case' 0 CA--C 1.491 -1.327 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.844 -173.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -66.56 -41.86 87.98 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.349 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 44.3 t -65.91 -48.07 72.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -65.57 -43.6 94.25 Favored Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 121.404 -0.427 . . . . 0.0 112.802 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.15 -47.4 57.98 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.436 -177.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . 0.428 HG23 ' NE2' ' A' ' 499' ' ' HIS . 93.7 t -64.62 -38.98 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 110.601 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -61.49 -36.78 81.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.284 0.564 . . . . 0.0 110.172 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.93 -46.4 37.18 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.018 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 31.4 mm -64.25 -28.15 44.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.423 0.689 . . . . 0.0 111.521 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -55.55 -39.37 70.53 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 122.887 0.475 . . . . 0.0 110.626 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -65.35 -40.98 94.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 43.1 t -63.4 -42.63 96.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.553 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.1 -46.31 96.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 38.9 m -61.59 -42.18 98.5 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.71 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -64.39 -43.41 94.52 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.5 tp . . . . . 0 C--O 1.242 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 110.537 177.779 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.63 0 CA-C-O 121.313 0.577 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . 0.536 HD13 ' CD2' ' A' ' 435' ' ' HIS . 3.0 mp -95.05 132.62 39.74 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.857 -172.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.09 118.83 15.45 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.87 -52.72 2.77 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -172.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.453 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 65.2 t90 -154.57 149.89 27.15 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.266 -171.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 22.8 t -131.81 130.05 41.28 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.453 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -162.33 -172.79 30.22 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -177.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.1 t -113.22 139.29 39.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.509 ' O ' ' HA ' ' A' ' 426' ' ' SER . 72.8 mt -113.92 140.96 47.95 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . 0.491 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 58.5 mt-10 -115.37 126.28 54.23 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 58.6 p-90 . . . . . 0 C--N 1.297 -1.701 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -173.539 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 426' ' ' SER . . . . . 0.509 ' HA ' ' O ' ' A' ' 406' ' ' LEU . 33.8 p -141.86 138.44 32.13 Favored 'General case' 0 N--CA 1.414 -2.254 0 O-C-N 123.459 0.475 . . . . 0.0 110.495 -175.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 96.8 mt -137.25 118.15 10.78 Favored Pre-proline 0 C--N 1.293 -1.883 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.695 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.27 138.62 56.55 Favored 'Trans proline' 0 C--O 1.249 1.056 0 C-N-CA 122.7 2.267 . . . . 0.0 109.542 170.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . 0.496 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 12.5 p -144.98 165.42 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -175.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -116.45 133.25 56.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.9 t -121.45 124.16 71.22 Favored 'Isoleucine or valine' 0 C--O 1.259 1.564 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.459 -174.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -105.25 160.81 14.81 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 175.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.478 HG13 HG13 ' A' ' 471' ' ' VAL . 15.5 m -121.97 140.57 45.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 175.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.524 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 27.1 t-20 -96.16 132.18 41.85 Favored 'General case' 1 C--O 1.316 4.565 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.28 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . 0.536 ' CD2' HD13 ' A' ' 399' ' ' LEU . 77.0 m-70 -33.0 160.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 O-C-N 128.305 3.503 . . . . 0.0 116.438 -170.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.74 -1.27 30.44 Favored Glycine 0 CA--C 1.497 -1.06 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.48 161.66 13.49 Favored 'General case' 0 C--N 1.289 -2.039 0 C-N-CA 126.194 1.798 . . . . 0.0 115.121 -172.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -159.36 98.88 1.44 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 168.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -139.19 139.38 37.5 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.732 -0.605 . . . . 0.0 112.163 -175.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -103.07 106.6 17.15 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 25.2 p -80.28 -2.79 46.67 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 122.215 1.007 . . . . 0.0 112.435 -175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.13 -14.22 60.94 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.225 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -101.45 9.61 41.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -99.08 140.64 21.85 Favored Pre-proline 0 C--O 1.247 0.945 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.368 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.64 153.99 64.54 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.877 1.718 . . . . 0.0 109.816 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -81.0 -5.16 57.25 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 92.3 mttt -132.21 126.21 33.0 Favored 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.341 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 73.5 mt -118.6 146.99 44.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 63.4 mt -105.02 125.97 59.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.501 -177.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 48.5 ttp -106.79 118.02 35.58 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -99.86 127.04 46.06 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 175.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . 0.473 HD11 HG22 ' A' ' 489' ' ' ILE . 29.6 mt -86.67 136.79 32.9 Favored 'General case' 0 C--N 1.28 -2.413 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.31 161.27 60.14 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.83 129.09 16.92 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.348 1.366 . . . . 0.0 111.234 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.37 -25.13 68.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.916 0.886 . . . . 0.0 111.77 -177.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -58.76 -37.04 75.37 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 120.851 0.358 . . . . 0.0 110.976 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 7.7 mp -83.3 3.21 32.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.298 0.57 . . . . 0.0 111.42 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.95 -16.45 61.53 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.882 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 18.8 p -58.74 -30.62 67.62 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.854 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 7.5 m -71.27 -18.81 62.41 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.538 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.02 5.28 38.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 122.106 -0.371 . . . . 0.0 111.806 -175.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.3 -55.44 3.04 Favored Glycine 0 CA--C 1.559 2.781 0 CA-C-N 114.854 -1.067 . . . . 0.0 115.304 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.23 -26.43 76.5 Favored 'Trans proline' 0 C--N 1.368 1.588 0 C-N-CA 123.405 2.737 . . . . 0.0 114.011 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.77 -46.12 66.51 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -72.64 -14.72 61.66 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.215 -178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -70.47 -24.77 62.92 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.357 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -122.2 85.04 2.35 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' SER . . . . . 0.418 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 53.2 m -151.73 163.04 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.639 0.733 . . . . 0.0 112.657 -175.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.37 142.91 41.4 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 126.28 1.832 . . . . 0.0 106.458 177.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.524 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 1.9 mmm -96.66 151.33 19.73 Favored 'General case' 0 CA--C 1.487 -1.447 0 C-N-CA 118.439 -1.305 . . . . 0.0 110.976 -168.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.478 HG13 HG13 ' A' ' 433' ' ' VAL . 35.9 m -135.21 154.34 35.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 C-N-CA 123.695 0.798 . . . . 0.0 109.239 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -134.14 123.64 24.74 Favored 'General case' 0 C--N 1.285 -2.215 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.444 ' CE2' HD13 ' A' ' 406' ' ' LEU . 25.6 m-85 -107.91 133.4 52.3 Favored 'General case' 0 C--O 1.278 2.564 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.901 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -131.03 123.63 29.13 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 172.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . 0.496 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 98.4 m-85 . . . . . 0 C--N 1.305 -1.356 0 O-C-N 123.091 0.244 . . . . 0.0 110.545 -177.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -69.52 -36.94 76.88 Favored 'General case' 0 C--N 1.31 -1.138 0 O-C-N 122.963 0.164 . . . . 0.0 111.248 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 66.6 m -67.42 -40.04 85.52 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.632 174.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . 0.414 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 3.7 mm? -63.76 -45.93 87.59 Favored 'General case' 0 C--O 1.206 -1.214 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.739 176.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -55.21 -45.68 75.91 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.811 0.444 . . . . 0.0 110.611 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.421 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.44 -44.23 74.38 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.033 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.72 -43.81 95.45 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.438 0.695 . . . . 0.0 109.883 -177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . 0.414 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 10.3 m-85 -56.91 -42.52 80.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.961 0.504 . . . . 0.0 111.053 177.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 492' ' ' ASN . 55.5 mtp180 -67.26 -44.57 79.05 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.816 178.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . 0.473 HG22 HD11 ' A' ' 452' ' ' LEU . 75.4 mt -61.04 -48.18 90.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 O-C-N 123.396 0.435 . . . . 0.0 110.688 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 20.7 mmt -63.64 -46.63 84.78 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -68.5 -20.61 73.87 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.408 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 488' ' ' ARG . 4.0 t30 -80.78 0.24 35.65 Favored 'General case' 0 C--O 1.245 0.866 0 CA-C-O 121.551 0.691 . . . . 0.0 110.197 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.99 31.09 6.4 Favored Glycine 0 N--CA 1.439 -1.128 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.384 177.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -109.88 162.22 14.7 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 122.36 -0.494 . . . . 0.0 110.396 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -135.93 150.17 49.2 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -111.63 111.72 2.97 Favored Glycine 0 N--CA 1.43 -1.731 0 C-N-CA 119.482 -1.342 . . . . 0.0 113.031 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.06 115.55 22.94 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 176.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 47.6 t -101.48 120.85 51.65 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 CA-C-O 121.575 0.702 . . . . 0.0 109.535 -175.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -111.5 139.82 46.61 Favored 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.086 -1.416 . . . . 0.0 110.508 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -102.21 133.43 20.62 Favored Pre-proline 0 C--N 1.292 -1.894 0 CA-C-N 113.915 -1.493 . . . . 0.0 108.761 -178.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo . . . . . 0 C--O 1.255 1.345 0 N-CA-C 107.815 -1.648 . . . . 0.0 107.815 167.012 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.241 0.611 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 31.8 mtt180 73.42 169.07 0.31 Allowed 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.249 1.42 . . . . 0.0 109.614 175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.537 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 16.0 m -131.1 163.91 35.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.903 -174.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.478 ' CB ' HG12 ' A' ' 526' ' ' ILE . 3.3 pp -138.33 154.96 48.98 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 118.068 -1.453 . . . . 0.0 110.541 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 41.3 ttm -117.25 130.1 56.34 Favored 'General case' 0 C--N 1.295 -1.772 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.534 173.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . 0.444 HD12 ' HB3' ' A' ' 522' ' ' PHE . 34.9 tp -95.63 129.78 42.72 Favored 'General case' 0 N--CA 1.411 -2.404 0 O-C-N 124.018 0.824 . . . . 0.0 108.991 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 64.4 mt -133.02 148.84 52.23 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.326 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -100.05 121.9 42.09 Favored 'General case' 0 C--N 1.271 -2.822 0 O-C-N 122.233 -0.292 . . . . 0.0 110.477 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 37.9 t -95.23 109.43 21.54 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.0 m -68.81 -35.41 76.96 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.733 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -69.6 -31.34 69.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.276 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -97.59 -9.99 25.97 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.842 0.353 . . . . 0.0 110.4 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 59.57 35.89 22.68 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 124.35 1.06 . . . . 0.0 111.413 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -143.01 167.5 14.07 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . 0.444 ' HB3' HD12 ' A' ' 513' ' ' LEU . 52.5 m-85 -98.83 138.57 35.78 Favored 'General case' 0 N--CA 1.413 -2.305 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.901 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.4 ptm -127.06 165.88 18.65 Favored 'General case' 0 C--N 1.284 -2.274 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.419 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -170.19 150.88 15.34 Favored Glycine 0 N--CA 1.41 -3.047 0 C-N-CA 119.054 -1.546 . . . . 0.0 112.055 177.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.463 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.8 mp -114.29 140.24 48.76 Favored 'General case' 0 C--N 1.273 -2.743 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.478 HG12 ' CB ' ' A' ' 511' ' ' LEU . 7.3 mt -99.24 108.05 47.89 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 123.793 0.683 . . . . 0.0 110.812 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.537 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 34.2 Cg_exo -68.69 131.2 22.23 Favored 'Trans proline' 0 C--O 1.295 3.348 0 C-N-CA 122.102 1.868 . . . . 0.0 110.963 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -74.63 -41.57 60.14 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.389 -1.732 . . . . 0.0 110.27 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -73.85 84.89 1.7 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.995 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -66.37 -43.79 84.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.127 -179.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 15.2 m -61.34 -44.0 97.92 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.31 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -68.56 -44.86 70.09 Favored Glycine 0 C--O 1.243 0.713 0 C-N-CA 121.171 -0.537 . . . . 0.0 112.866 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.482 ' CE2' HG13 ' A' ' 537' ' ' ILE . 67.6 t80 -67.4 -48.27 67.85 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 122.126 0.17 . . . . 0.0 111.117 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.2 -37.94 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 O-C-N 123.187 0.304 . . . . 0.0 110.567 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -58.2 -46.91 84.99 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.039 0.447 . . . . 0.0 110.383 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.95 -43.38 49.65 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.706 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 541' ' ' ILE . 32.8 mm -62.03 -36.24 73.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 122.383 0.273 . . . . 0.0 111.56 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -60.65 -35.4 76.1 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.202 0.525 . . . . 0.0 110.672 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.07 -37.71 75.55 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.31 -37.94 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.642 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 537' ' ' ILE . 43.8 mm -60.39 -45.68 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 92.4 m -59.68 -42.93 94.03 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.658 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -67.43 -37.29 82.81 Favored 'General case' 0 C--O 1.203 -1.39 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.558 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' A' ' 541' ' ' ILE . 51.9 tp . . . . . 0 C--N 1.315 -0.92 0 C-N-CA 124.197 0.999 . . . . 0.0 111.372 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . 0.432 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.328 0 CA-C-O 121.507 0.67 . . . . 0.0 112.375 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . 0.472 HD13 ' ND1' ' A' ' 435' ' ' HIS . 3.2 mp -115.25 137.47 52.0 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 171.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.46 121.7 17.51 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.39 -57.08 2.13 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.443 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 61.2 t90 -153.37 145.36 23.66 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 120.895 0.379 . . . . 0.0 111.188 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 25.0 p -119.72 126.91 52.22 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.443 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -165.47 -172.23 32.64 Favored Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.328 -176.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . 0.486 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 59.5 t -113.19 135.54 52.37 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -177.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.417 ' CD1' ' HB2' ' A' ' 448' ' ' LEU . 15.7 tp -113.94 136.81 52.48 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . 0.436 ' HG2' ' CB ' ' A' ' 426' ' ' SER . 51.6 mt-10 -114.54 133.87 55.46 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -178.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 51.1 p-90 . . . . . 0 C--N 1.295 -1.781 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.352 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 42.4 mmt180 . . . . . 0 N--CA 1.411 -2.405 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 426' ' ' SER . . . . . 0.436 ' CB ' ' HG2' ' A' ' 407' ' ' GLU . 1.0 OUTLIER -137.85 130.14 29.17 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -177.315 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 90.3 mt -131.47 126.73 21.34 Favored Pre-proline 0 C--N 1.294 -1.809 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -60.23 138.71 83.06 Favored 'Trans proline' 0 C--O 1.249 1.03 0 C-N-CA 122.286 1.991 . . . . 0.0 110.742 172.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.6 p -145.95 157.4 43.89 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.038 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -117.36 129.37 55.83 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 46.5 t -113.67 124.2 70.08 Favored 'Isoleucine or valine' 0 C--O 1.257 1.469 0 CA-C-O 121.732 0.777 . . . . 0.0 111.129 -173.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.54 161.34 15.15 Favored 'General case' 0 C--N 1.28 -2.415 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.321 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 6.1 m -119.79 140.71 42.92 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 174.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.509 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 26.8 t-20 -94.06 130.13 40.32 Favored 'General case' 1 C--O 1.339 5.809 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 171.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . 0.472 ' ND1' HD13 ' A' ' 399' ' ' LEU . 0.5 OUTLIER -47.53 165.05 0.03 OUTLIER 'General case' 0 C--N 1.357 0.893 0 O-C-N 128.931 3.894 . . . . 0.0 115.372 -162.385 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . 0.434 ' H ' ' CD2' ' A' ' 435' ' ' HIS . . . 110.14 -2.98 29.88 Favored Glycine 0 N--CA 1.423 -2.168 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -172.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.442 ' OE1' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -132.38 159.59 38.79 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.558 -174.403 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -152.57 98.67 2.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 170.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . 0.534 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -118.82 158.53 25.45 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.947 0.403 . . . . 0.0 111.91 -177.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -102.14 118.13 36.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 20.2 p -95.97 8.0 44.85 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.346 1.069 . . . . 0.0 109.626 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.81 -22.84 66.59 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.205 -1.362 . . . . 0.0 111.412 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -107.47 17.27 22.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.036 0.446 . . . . 0.0 111.532 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -91.17 136.03 27.7 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.433 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -64.43 158.75 47.65 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.156 1.904 . . . . 0.0 109.469 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.02 -7.09 59.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.123 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 88.8 mttt -128.5 130.38 47.41 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 122.756 0.422 . . . . 0.0 110.59 176.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . 0.417 ' HB2' ' CD1' ' A' ' 406' ' ' LEU . 83.8 mt -119.16 147.27 44.38 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 43.9 mm -99.22 120.54 48.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.459 ' SD ' HD21 ' A' ' 513' ' ' LEU . 56.2 ttp -111.96 119.28 37.96 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.067 0.46 . . . . 0.0 111.333 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -104.9 133.16 50.17 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.02 122.09 29.56 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 120.969 0.414 . . . . 0.0 111.0 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 pt -129.77 157.81 75.58 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.676 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.41 129.34 29.3 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 121.832 1.688 . . . . 0.0 113.134 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.74 -25.46 68.21 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.197 0.999 . . . . 0.0 111.57 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -57.62 -41.49 81.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.584 0.753 . . . . 0.0 111.742 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.04 5.58 21.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.133 -172.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.97 -27.21 36.09 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.599 -178.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -31.43 67.08 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -174.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.7 m -72.46 -17.85 61.73 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.364 0.666 . . . . 0.0 112.439 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 10.8 tp -85.6 11.12 11.41 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.304 0.642 . . . . 0.0 111.318 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -37.6 -54.54 1.77 Allowed Glycine 0 CA--C 1.545 1.966 0 N-CA-C 116.667 1.427 . . . . 0.0 116.667 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.21 -40.67 51.54 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 123.07 2.513 . . . . 0.0 113.424 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.76 -30.45 70.67 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.201 0.524 . . . . 0.0 111.355 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -78.07 -13.11 59.99 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.444 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -74.78 -43.33 55.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.621 175.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -95.54 74.2 3.24 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 122.025 0.917 . . . . 0.0 110.057 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -142.32 169.85 16.81 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.95 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.534 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 14.3 ptp180 -139.63 143.79 37.37 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 127.529 2.332 . . . . 0.0 105.724 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.509 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 62.1 mtp -97.23 153.12 18.22 Favored 'General case' 0 CA--C 1.483 -1.599 0 C-N-CA 115.982 -2.287 . . . . 0.0 111.875 -167.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 34.8 m -133.03 159.76 42.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.993 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.28 121.39 21.21 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 14.1 m-85 -107.3 117.65 34.65 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.198 -177.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -111.87 122.27 47.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 C--N 1.303 -1.456 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.532 -176.08 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -69.91 -41.5 74.58 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 120.809 0.337 . . . . 0.0 111.211 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 35.7 m -63.67 -35.31 80.12 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.749 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 93.5 mt -73.03 -51.41 18.26 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.04 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -55.33 -36.77 66.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.193 0.597 . . . . 0.0 111.628 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.495 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -60.51 -50.83 63.26 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.02 -42.8 89.15 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 123.251 0.62 . . . . 0.0 110.772 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -58.26 -45.51 87.69 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.18 0.592 . . . . 0.0 110.295 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -65.41 -38.57 90.35 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.391 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 485' ' ' GLY . 80.4 mt -68.21 -50.38 58.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.988 0.423 . . . . 0.0 110.572 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' MET . . . . . 0.487 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 91.8 mtp -70.72 -35.79 72.89 Favored 'General case' 0 C--N 1.312 -1.039 0 O-C-N 122.134 -0.354 . . . . 0.0 111.592 -176.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.76 -18.66 70.56 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -81.92 6.84 14.61 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.869 0.842 . . . . 0.0 110.107 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.35 29.73 6.94 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.529 -0.843 . . . . 0.0 113.015 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -112.45 158.67 19.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -129.28 160.14 33.92 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -115.1 115.81 3.55 Favored Glycine 0 N--CA 1.417 -2.599 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . 0.413 ' SG ' HG22 ' A' ' 537' ' ' ILE . 42.6 t -92.74 118.89 31.55 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . 0.403 HG21 ' HB2' ' A' ' 450' ' ' MET . 78.0 t -101.66 120.78 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 CA-C-O 121.361 0.6 . . . . 0.0 110.151 -178.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . 0.494 ' NE2' HG21 ' A' ' 534' ' ' VAL . 27.1 m80 -109.36 140.46 43.02 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.41 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' A' ' 510' ' ' VAL . 4.2 m-85 -104.06 125.89 33.21 Favored Pre-proline 0 C--N 1.292 -1.934 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.535 -175.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo . . . . . 0 N--CA 1.459 -0.501 0 C-N-CA 121.902 1.735 . . . . 0.0 108.351 172.168 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.437 -1.099 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 20.4 mtm-85 72.82 177.08 0.26 Allowed 'General case' 0 C--N 1.371 1.51 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.274 177.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.483 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 5.6 m -133.83 162.33 39.58 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.664 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.541 ' HB2' HG12 ' A' ' 526' ' ' ILE . 0.9 OUTLIER -134.19 136.52 43.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.08 0.854 . . . . 0.0 113.172 -171.429 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' MET . . . . . 0.451 ' N ' HD21 ' A' ' 511' ' ' LEU . 49.1 tpp -101.83 118.83 37.74 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . 0.459 HD21 ' SD ' ' A' ' 450' ' ' MET . 24.2 tp -105.14 126.62 52.28 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.531 0.681 . . . . 0.0 110.183 -177.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 79.6 mt -123.97 135.04 53.38 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.184 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -89.61 123.44 33.68 Favored 'General case' 0 C--N 1.285 -2.212 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.335 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.3 t -98.72 110.19 22.83 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 31.7 m -68.33 -27.25 66.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.494 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.17 -44.13 96.29 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.422 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -103.79 1.09 31.2 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.821 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . 0.421 0.0 OUTLIER 49.15 34.92 6.44 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.11 2.164 . . . . 0.0 114.421 -176.352 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -137.62 167.83 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.802 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.095 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . 0.487 ' HE1' ' SD ' ' A' ' 490' ' ' MET . 70.0 m-85 -98.19 136.79 37.9 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.233 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -119.56 145.91 45.96 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -156.23 154.12 25.27 Favored Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 118.285 -1.912 . . . . 0.0 113.516 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 10.6 mp -115.37 135.02 54.56 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 171.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.541 HG12 ' HB2' ' A' ' 511' ' ' LEU . 16.5 mt -101.36 107.45 50.84 Favored Pre-proline 0 N--CA 1.439 -0.983 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.566 ' HG2' ' CD2' ' A' ' 533' ' ' PHE . 35.9 Cg_exo -72.19 138.46 30.62 Favored 'Trans proline' 0 C--O 1.292 3.179 0 C-N-CA 122.994 2.463 . . . . 0.0 111.944 170.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -77.07 -43.07 35.74 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.302 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.41 92.25 4.57 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.64 0.734 . . . . 0.0 110.156 -176.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . 0.253 0.0 OUTLIER -67.21 -31.08 71.21 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 114.959 -1.018 . . . . 0.0 113.569 -179.367 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.3 m -62.83 -47.55 82.9 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -176.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.98 -34.69 52.07 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.229 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.566 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 49.9 t80 -68.36 -48.08 65.73 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . 0.494 HG21 ' NE2' ' A' ' 499' ' ' HIS . 95.2 t -64.44 -39.12 84.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 O-C-N 123.181 0.3 . . . . 0.0 110.508 -178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -67.12 -40.38 86.8 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 109.762 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -64.09 -46.53 90.96 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.54 ' O ' HG13 ' A' ' 541' ' ' ILE . 43.7 mm -64.01 -37.38 79.65 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 C-N-CA 122.247 0.219 . . . . 0.0 110.799 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -57.87 -39.67 78.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 110.119 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . 0.404 ' HA ' HG21 ' A' ' 542' ' ' THR . 49.0 mt-30 -67.66 -34.09 76.23 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 91.1 t -67.41 -48.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.748 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 537' ' ' ILE . 62.2 mt -60.97 -44.88 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' THR . . . . . 0.404 HG21 ' HA ' ' A' ' 539' ' ' GLN . 1.9 t -67.86 -33.55 74.97 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.822 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.25 -42.55 88.42 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 123.577 0.751 . . . . 0.0 110.664 178.964 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.425 -1.712 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . 0.473 HD13 ' CD2' ' A' ' 435' ' ' HIS . 3.2 mp -108.68 136.29 48.51 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 64.1 tp -70.1 118.83 13.43 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.19 -51.24 2.86 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.491 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 78.4 t90 -155.19 149.21 25.72 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.459 -172.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 13.1 p -130.61 117.63 19.81 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 176.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.491 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -159.54 -172.53 26.83 Favored Glycine 0 N--CA 1.433 -1.562 0 C-N-CA 119.795 -1.193 . . . . 0.0 112.589 -175.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -112.03 136.69 47.43 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-O 121.099 0.476 . . . . 0.0 109.876 -176.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.519 HD12 ' SG ' ' A' ' 429' ' ' CYS . 10.4 mp -113.19 139.08 49.07 Favored 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . 0.481 ' HG3' ' HB3' ' A' ' 426' ' ' SER . 30.2 tt0 -116.22 126.83 54.16 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -178.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . 0.409 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 19.3 p-90 . . . . . 0 C--N 1.302 -1.491 0 CA-C-O 121.46 0.647 . . . . 0.0 112.584 -175.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.416 -2.164 0 CA-C-O 121.056 0.455 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 426' ' ' SER . . . . . 0.481 ' HB3' ' HG3' ' A' ' 407' ' ' GLU . 51.4 p -142.2 138.55 31.57 Favored 'General case' 0 N--CA 1.409 -2.506 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 81.1 mt -135.41 135.77 23.0 Favored Pre-proline 0 C--N 1.307 -1.242 0 O-C-N 122.852 0.095 . . . . 0.0 110.861 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.45 135.93 20.9 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.573 2.182 . . . . 0.0 112.043 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . 0.519 ' SG ' HD12 ' A' ' 406' ' ' LEU . 20.3 p -142.29 167.13 22.84 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.493 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -115.79 129.88 56.62 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 45.3 t -114.05 123.98 70.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.719 0 CA-C-O 122.143 0.973 . . . . 0.0 110.792 -175.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -113.47 160.42 18.48 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 114.035 -1.439 . . . . 0.0 107.39 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.493 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 15.4 m -122.75 141.77 41.87 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 CA-C-O 120.694 0.283 . . . . 0.0 111.6 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 470' ' ' MET . 3.0 m120 -94.59 132.16 39.59 Favored 'General case' 1 C--O 1.314 4.448 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 168.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . 0.473 ' CD2' HD13 ' A' ' 399' ' ' LEU . 73.4 m-70 -39.26 165.72 0.0 OUTLIER 'General case' 0 C--N 1.37 1.463 0 O-C-N 127.387 2.929 . . . . 0.0 116.197 -168.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.33 -2.39 31.1 Favored Glycine 0 CA--C 1.502 -0.766 0 N-CA-C 109.096 -1.601 . . . . 0.0 109.096 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.404 ' CB ' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -106.63 161.91 14.22 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.05 -1.075 . . . . 0.0 113.118 -174.439 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -160.88 94.49 1.03 Allowed 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . 0.501 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 2.3 pt? -141.92 151.22 42.41 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.252 178.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -102.47 135.49 44.0 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 14.0 p -94.6 23.15 5.54 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -171.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -75.55 -28.33 58.97 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.255 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -72.07 -15.52 62.01 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.208 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -88.24 126.84 59.32 Favored Pre-proline 0 C--N 1.311 -1.07 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.455 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . 0.404 ' HG2' ' HD2' ' A' ' 501' ' ' PRO . 23.5 Cg_exo -69.84 157.88 58.73 Favored 'Trans proline' 0 C--O 1.224 -0.223 0 C-N-CA 122.186 1.924 . . . . 0.0 110.05 173.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -77.35 -5.98 51.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.128 0.489 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -119.9 124.94 47.27 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 53.2 mt -118.17 146.69 44.01 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 71.8 mt -101.93 117.79 47.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.887 -176.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 497' ' ' CYS . 23.3 ptm -112.82 128.96 56.58 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 121.586 0.708 . . . . 0.0 110.067 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -114.76 130.75 56.89 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.99 124.63 29.31 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.498 0.666 . . . . 0.0 111.503 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.6 pt -133.82 161.42 63.84 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.395 1.078 . . . . 0.0 108.814 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -65.64 128.98 21.18 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 121.385 1.39 . . . . 0.0 111.406 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -63.86 -26.61 68.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.586 0.754 . . . . 0.0 110.388 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.27 -33.02 67.19 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.335 1.054 . . . . 0.0 112.7 -174.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.06 8.79 22.03 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -177.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 39.0 tp -69.73 -22.68 63.36 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.303 0.573 . . . . 0.0 110.483 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 5.1 m -65.62 -29.52 70.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.671 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 9.9 m -72.04 -20.39 61.69 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.757 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 83.1 mt -96.03 10.33 37.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.599 -175.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.22 -51.5 8.99 Favored Glycine 0 CA--C 1.553 2.462 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.1 -19.5 66.6 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.893 2.395 . . . . 0.0 113.94 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -80.16 -42.36 23.57 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -71.68 -13.66 61.8 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.583 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -53.86 -31.79 50.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.14 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -138.13 97.84 3.49 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.9 m -150.4 170.21 19.59 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.292 0.568 . . . . 0.0 111.553 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . 0.501 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 97.3 mtt180 -112.52 142.51 45.0 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.478 ' HB2' ' HB2' ' A' ' 434' ' ' ASN . 61.5 mtp -98.78 151.96 20.22 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 116.944 -1.903 . . . . 0.0 111.242 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 524' ' ' GLY . 26.4 m -135.09 155.39 37.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.891 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -127.76 129.76 47.59 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.465 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 25.0 m-85 -112.88 117.98 33.63 Favored 'General case' 0 C--N 1.282 -2.326 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.847 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -121.31 123.73 42.88 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 . . . . . 0 C--N 1.296 -1.722 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.624 -179.817 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 N--CA 1.448 -0.55 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -70.5 -36.55 73.86 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.944 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 38.7 m -65.09 -38.0 89.34 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.13 -41.86 89.91 Favored 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.007 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -54.41 -41.26 69.11 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.037 0.535 . . . . 0.0 111.6 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.482 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -63.15 -46.51 93.05 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.708 178.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.0 tp -66.7 -41.59 87.77 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.73 0.412 . . . . 0.0 110.737 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -61.16 -38.89 88.09 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.237 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -66.39 -46.0 78.13 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 485' ' ' GLY . 67.6 mt -62.55 -51.15 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' MET . . . . . 0.488 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 85.3 mtp -73.46 -36.19 65.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.117 0.484 . . . . 0.0 111.558 -176.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.34 71.03 Favored Glycine 0 C--O 1.219 -0.804 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.602 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.5 4.97 25.62 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.036 0.934 . . . . 0.0 110.611 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.57 29.52 6.96 Favored Glycine 0 C--N 1.316 -0.581 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.042 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -112.61 147.38 36.82 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 174.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -118.61 159.98 22.62 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.05 115.87 3.19 Favored Glycine 0 N--CA 1.421 -2.327 0 C-N-CA 120.189 -1.005 . . . . 0.0 110.721 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.1 t -88.32 128.3 35.49 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 75.6 t -100.99 120.57 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-O 121.664 0.745 . . . . 0.0 109.3 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -113.42 134.66 54.53 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -84.12 132.24 48.58 Favored Pre-proline 0 C--N 1.289 -2.061 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.035 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . 0.404 ' HD2' ' HG2' ' A' ' 445' ' ' PRO . 31.4 Cg_exo . . . . . 0 N--CA 1.493 1.49 0 C-N-CA 123.595 2.863 . . . . 0.0 114.72 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.0 t . . . . . 0 C--O 1.243 0.72 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 75.14 -178.67 0.16 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.395 1.478 . . . . 0.0 109.754 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.551 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.7 m -138.14 162.83 30.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.854 -0.739 . . . . 0.0 109.855 176.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 17.7 tp -135.01 150.04 50.26 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -170.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 40.2 tpp -108.93 140.78 41.95 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 52.7 tp -125.57 122.89 37.81 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.244 0.545 . . . . 0.0 109.952 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 73.3 mt -126.98 139.31 53.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.114 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -93.83 124.55 37.9 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.559 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 16.9 m -106.7 110.58 22.8 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 18.5 m -68.57 -35.68 77.71 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.834 -1.075 . . . . 0.0 113.218 -174.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -77.3 -29.41 53.69 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 121.449 0.643 . . . . 0.0 110.113 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -87.32 -10.62 51.78 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.89 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 58.24 27.41 15.13 Favored 'General case' 0 C--N 1.345 0.371 0 C-N-CA 124.876 1.27 . . . . 0.0 111.709 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.33 166.58 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.568 0 CA-C-O 121.232 0.539 . . . . 0.0 111.688 -176.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . 0.488 ' HE1' ' SD ' ' A' ' 490' ' ' MET . 42.5 m-85 -98.49 138.57 35.52 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 58.3 ttp -133.35 143.08 48.74 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.501 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -151.89 158.94 28.05 Favored Glycine 0 N--CA 1.414 -2.77 0 C-N-CA 119.253 -1.451 . . . . 0.0 112.475 -178.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.458 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 10.3 mp -115.3 139.45 49.96 Favored 'General case' 0 C--N 1.291 -1.94 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 510' ' ' VAL . 4.9 tt -107.05 108.32 61.81 Favored Pre-proline 0 C--O 1.254 1.324 0 CA-C-O 120.941 0.4 . . . . 0.0 111.65 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.508 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.2 Cg_exo -72.12 138.66 31.17 Favored 'Trans proline' 0 C--O 1.294 3.294 0 C-N-CA 123.433 2.755 . . . . 0.0 113.066 172.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -71.3 -45.32 63.34 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 113.114 -1.857 . . . . 0.0 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.02 104.69 13.41 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.364 0.602 . . . . 0.0 111.166 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -36.07 81.12 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.626 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 80.3 p -63.71 -47.66 80.22 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -72.1 -38.74 59.32 Favored Glycine 0 N--CA 1.434 -1.477 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.432 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . 0.482 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 44.9 t80 -71.05 -47.36 58.94 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.245 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.55 -38.53 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.318 0.58 . . . . 0.0 109.61 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -59.59 -41.47 90.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.809 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -67.85 -41.81 87.58 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.176 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.513 ' O ' HG13 ' A' ' 541' ' ' ILE . 47.6 mm -61.55 -36.7 74.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 122.492 0.317 . . . . 0.0 110.433 177.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -56.39 -38.69 71.82 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.863 0.363 . . . . 0.0 110.525 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -67.3 -41.8 84.79 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.28 -43.87 98.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.118 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 537' ' ' ILE . 71.9 mt -59.98 -44.58 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.464 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 83.4 m -62.84 -38.94 92.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.741 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -67.55 -38.21 83.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.087 0.47 . . . . 0.0 110.026 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.988 178.061 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 63.6 mttp . . . . . 0 N--CA 1.427 -1.584 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . 0.457 HD13 ' CD2' ' A' ' 435' ' ' HIS . 3.5 mp -90.33 122.49 33.27 Favored 'General case' 0 C--N 1.284 -2.256 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.096 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 60.0 tp -62.36 116.35 4.98 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 175.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.29 -52.92 2.26 Favored 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.533 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 51.4 t90 -146.34 133.66 20.65 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 118.85 -1.14 . . . . 0.0 112.71 -170.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 38.5 t -111.2 119.94 40.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.533 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.08 -173.46 26.53 Favored Glycine 0 N--CA 1.426 -1.974 0 C-N-CA 119.411 -1.376 . . . . 0.0 112.43 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.2 142.44 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . 0.414 HD12 ' CE1' ' A' ' 473' ' ' PHE . 88.9 mt -112.67 138.49 49.39 Favored 'General case' 0 C--N 1.293 -1.868 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . 0.501 ' CG ' ' HB3' ' A' ' 426' ' ' SER . 26.3 mt-10 -115.67 125.73 53.23 Favored 'General case' 0 N--CA 1.402 -2.858 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.979 175.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 . . . . . 0 C--N 1.285 -2.227 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.374 -175.365 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 31.0 mmt180 . . . . . 0 CA--C 1.505 -0.777 0 CA-C-O 120.479 0.18 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 426' ' ' SER . . . . . 0.501 ' HB3' ' CG ' ' A' ' 407' ' ' GLU . 2.9 p -110.84 139.94 45.72 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -173.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . 0.402 HD11 HD21 ' A' ' 483' ' ' LEU . 77.2 mt -137.12 125.09 14.5 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.985 175.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.23 146.62 32.07 Favored 'Trans proline' 0 C--O 1.248 0.979 0 C-N-CA 122.707 2.271 . . . . 0.0 111.605 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 21.7 p -147.49 167.46 24.4 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.817 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -116.48 129.89 56.46 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 41.4 t -124.87 123.85 66.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.923 0 CA-C-O 121.988 0.899 . . . . 0.0 112.18 -175.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -109.13 158.6 17.63 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.494 HG11 HG13 ' A' ' 471' ' ' VAL . 27.8 m -121.77 139.82 47.66 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.994 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.574 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 48.6 t30 -95.72 131.83 41.57 Favored 'General case' 1 C--O 1.308 4.158 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 174.202 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . 0.475 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 29.1 m-70 -37.41 153.19 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 O-C-N 127.773 3.171 . . . . 0.0 116.448 -167.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.54 -2.42 30.77 Favored Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.929 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 435' ' ' HIS . 1.0 OUTLIER -82.36 161.08 22.66 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 124.281 1.032 . . . . 0.0 112.638 -173.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -146.02 96.05 2.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.618 167.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . 0.443 HD21 HG21 ' A' ' 441' ' ' THR . 0.0 OUTLIER -140.34 141.37 35.67 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.088 175.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -104.06 106.85 17.5 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 105.107 -2.183 . . . . 0.0 105.107 166.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' THR . . . . . 0.443 HG21 HD21 ' A' ' 439' ' ' LEU . 8.1 p -70.13 -12.68 61.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.021 0.915 . . . . 0.0 112.588 -175.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -68.49 -22.75 64.53 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.63 174.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -103.58 12.52 34.88 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 122.305 1.05 . . . . 0.0 108.982 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 9.9 m0 -93.57 140.55 23.16 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -70.89 144.83 49.05 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 122.042 1.828 . . . . 0.0 109.045 171.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -81.35 -5.25 57.65 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.918 0.39 . . . . 0.0 111.183 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -128.25 120.19 26.66 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.994 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.33 147.18 41.82 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.9 mm -99.23 123.2 51.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.815 0.34 . . . . 0.0 110.207 -175.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.26 135.41 53.87 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.109 0.48 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . 0.568 ' HB3' ' SG ' ' A' ' 497' ' ' CYS . 8.1 tp-100 -117.83 131.13 56.6 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.94 125.07 33.8 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.9 pt -134.2 159.86 70.73 Favored Pre-proline 0 C--N 1.317 -0.839 0 C-N-CA 123.218 0.607 . . . . 0.0 110.16 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -64.11 129.31 23.98 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 121.861 1.707 . . . . 0.0 112.1 176.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.55 -29.52 70.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.676 0.79 . . . . 0.0 111.386 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -57.75 -41.2 81.41 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.132 0.491 . . . . 0.0 111.93 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 73.8 mt -76.16 -8.73 57.69 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.568 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 51.1 tp -70.15 -16.79 63.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.582 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.5 t -60.5 -25.18 65.89 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-O 121.026 0.441 . . . . 0.0 111.316 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 5.3 m -71.31 -19.33 62.33 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.438 0.695 . . . . 0.0 110.652 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.0 4.27 52.78 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.999 0.428 . . . . 0.0 111.443 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.32 -54.23 3.28 Favored Glycine 0 CA--C 1.548 2.129 0 CA-C-N 114.319 -1.31 . . . . 0.0 115.583 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.5 -20.84 51.26 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 122.914 2.409 . . . . 0.0 114.723 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.72 -36.96 59.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.835 -0.54 . . . . 0.0 110.884 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -68.97 -13.21 62.31 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.865 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.61 -36.13 79.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.85 89.02 3.03 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 109.592 175.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.3 m -144.14 160.17 41.38 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.342 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -111.23 141.93 44.1 Favored 'General case' 0 C--N 1.284 -2.269 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.574 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 72.4 mtp -98.39 153.01 18.88 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 118.036 -1.466 . . . . 0.0 112.159 -170.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.494 HG13 HG11 ' A' ' 433' ' ' VAL . 22.1 m -134.18 162.15 39.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.596 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -133.29 123.08 24.84 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 173.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . 0.414 ' CE1' HD12 ' A' ' 406' ' ' LEU . 17.2 m-85 -107.72 134.39 50.76 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.898 0.749 . . . . 0.0 110.068 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -133.93 123.51 24.81 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 172.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 . . . . . 0 C--N 1.289 -2.03 0 C-N-CA 121.204 -0.198 . . . . 0.0 110.761 -178.19 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -70.64 -41.7 71.82 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 9.3 t -67.75 -43.07 80.74 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . 0.438 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 83.8 mt -64.69 -30.16 71.17 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.84 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 88.0 tttt -54.99 -47.27 74.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.115 0.566 . . . . 0.0 110.817 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -64.38 -42.04 97.85 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.957 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.8 tt -65.03 -45.05 87.06 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . 0.438 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -60.31 -40.3 90.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.285 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . 0.537 ' HA ' ' CZ ' ' A' ' 488' ' ' ARG . 2.6 mmp_? -62.92 -50.28 71.46 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.714 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 76.3 mt -57.71 -45.47 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 122.703 0.401 . . . . 0.0 110.649 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 19.0 mmt -63.92 -43.87 94.59 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.312 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.93 -22.59 74.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.337 -0.392 . . . . 0.0 112.335 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -76.76 -7.02 54.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.822 0.449 . . . . 0.0 111.641 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.4 30.4 6.96 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 119.373 -1.394 . . . . 0.0 112.482 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.73 162.24 13.7 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -125.18 158.35 34.19 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -117.41 108.24 1.67 Allowed Glycine 0 N--CA 1.426 -1.988 0 C-N-CA 120.3 -0.952 . . . . 0.0 111.601 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 451' ' ' GLN . 10.6 p -83.87 118.55 24.04 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.4 121.28 55.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.17 136.09 50.74 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.219 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -97.64 133.46 23.54 Favored Pre-proline 0 C--N 1.291 -1.959 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo . . . . . 0 N--CA 1.454 -0.838 0 N-CA-C 107.909 -1.612 . . . . 0.0 107.909 169.117 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 CA--C 1.52 -0.209 0 N-CA-C 107.416 -1.328 . . . . 0.0 107.416 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . 0.545 ' HB3' ' O ' ' A' ' 527' ' ' PRO . 11.1 mmt180 -98.06 -166.76 1.42 Allowed 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.091 -168.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.497 ' O ' HG21 ' A' ' 526' ' ' ILE . 22.6 m -121.53 163.07 19.93 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.151 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.944 -177.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.543 ' HB2' HG12 ' A' ' 526' ' ' ILE . 14.4 tp -130.91 145.81 52.13 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -170.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 32.4 tpp -113.42 120.71 41.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.308 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 45.9 tp -105.87 126.8 52.61 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.226 0.536 . . . . 0.0 110.076 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 80.7 mt -132.36 148.75 52.43 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.435 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.25 128.65 52.02 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-O 120.702 0.286 . . . . 0.0 110.773 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 18.8 m -107.86 110.66 22.49 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.5 p -68.18 -35.87 78.71 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 124.43 1.092 . . . . 0.0 113.218 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.86 -33.38 66.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -97.39 -3.65 39.86 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.42 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 24.9 tptp 59.67 36.62 22.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.795 1.238 . . . . 0.0 111.298 177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -140.66 165.59 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.981 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.044 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -103.39 132.52 49.58 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.0 ptm -110.8 157.6 19.61 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.443 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -164.23 143.59 8.69 Favored Glycine 0 N--CA 1.405 -3.418 0 C-N-CA 119.094 -1.527 . . . . 0.0 112.021 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . 0.47 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 11.0 mp -114.92 137.74 51.63 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 172.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.543 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.8 mt -107.11 106.97 59.75 Favored Pre-proline 0 N--CA 1.428 -1.551 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.545 ' O ' ' HB3' ' A' ' 509' ' ' ARG . 29.4 Cg_exo -70.32 134.01 25.82 Favored 'Trans proline' 0 C--O 1.292 3.212 0 C-N-CA 123.186 2.591 . . . . 0.0 112.189 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -76.78 -27.43 55.28 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 113.37 -1.741 . . . . 0.0 112.058 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.04 90.11 7.99 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -66.82 -33.69 76.17 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.926 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.4 p -58.27 -48.32 80.81 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -174.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.76 -34.36 43.69 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.801 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -68.52 -47.7 66.27 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -177.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . 0.505 ' O ' ' HG3' ' A' ' 538' ' ' ARG . 89.6 t -62.65 -40.69 89.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 O-C-N 123.352 0.407 . . . . 0.0 110.22 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -57.64 -45.93 84.82 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . 0.44 ' O ' HG22 ' A' ' 540' ' ' VAL . . . -69.18 -44.95 63.7 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.73 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 41.8 mm -63.32 -34.07 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 122.558 0.343 . . . . 0.0 111.754 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 534' ' ' VAL . 56.9 mtp180 -56.17 -46.77 79.22 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.94 -39.94 95.31 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.742 0.651 . . . . 0.0 109.57 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 536' ' ' GLY . 97.7 t -60.86 -48.09 90.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.553 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 79.5 mt -61.81 -45.47 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.07 0.462 . . . . 0.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 54.3 m -62.06 -40.37 95.55 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.647 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -67.69 -36.77 81.29 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 CA--C 1.542 0.665 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.27 176.586 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 398' ' ' LYS . . . . . 0.431 ' HD3' ' O ' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.282 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 399' ' ' LEU . . . . . 0.511 HD12 ' HD1' ' A' ' 435' ' ' HIS . 2.4 mp -108.84 119.34 39.25 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 67.1 tp -69.02 121.46 16.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -120.67 -46.02 2.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -176.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 402' ' ' TRP . . . . . 0.499 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 41.7 t90 -150.05 149.23 30.03 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.385 -174.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 10.3 p -133.66 117.71 17.32 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 173.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 404' ' ' GLY . . . . . 0.499 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.75 -172.29 25.67 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.306 -173.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 405' ' ' VAL . . . . . 0.455 HG11 ' HB2' ' A' ' 426' ' ' SER . 58.2 t -114.98 142.65 27.02 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 CA-C-O 121.023 0.44 . . . . 0.0 109.924 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 89.1 mt -113.05 133.36 55.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -116.29 134.41 54.93 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 408' ' ' TRP . . . . . 0.441 ' HB3' ' HB2' ' A' ' 450' ' ' MET . 14.4 p-90 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -173.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.367 0 CA-C-O 120.434 0.159 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 426' ' ' SER . . . . . 0.455 ' HB2' HG11 ' A' ' 405' ' ' VAL . 60.4 p -131.65 159.27 38.81 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -170.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 50.8 mt -127.09 135.32 27.22 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.651 0.78 . . . . 0.0 110.021 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -82.47 132.6 6.92 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.821 2.347 . . . . 0.0 112.208 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 23.7 p -143.71 163.85 32.12 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.377 0.608 . . . . 0.0 112.212 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -116.77 130.06 56.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 43.0 t -117.64 123.78 72.19 Favored 'Isoleucine or valine' 0 C--O 1.268 2.059 0 CA-C-O 122.071 0.938 . . . . 0.0 110.768 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -109.88 158.24 18.39 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.436 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 433' ' ' VAL . . . . . 0.431 HG13 HG11 ' A' ' 471' ' ' VAL . 33.4 m -121.67 141.52 41.77 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.37 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 434' ' ' ASN . . . . . 0.508 ' HB2' ' CB ' ' A' ' 470' ' ' MET . 11.7 m120 -94.51 130.28 40.98 Favored 'General case' 1 C--O 1.308 4.147 0 N-CA-C 103.3 -2.852 . . . . 0.0 103.3 163.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 435' ' ' HIS . . . . . 0.511 ' HD1' HD12 ' A' ' 399' ' ' LEU 0.309 31.6 p-80 -63.47 -175.91 0.14 Allowed 'General case' 0 N--CA 1.426 -1.641 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 -160.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.44 -11.25 33.28 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 105.337 -3.105 . . . . 0.0 105.337 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -128.91 149.02 50.96 Favored 'General case' 0 N--CA 1.383 -3.811 0 C-N-CA 127.306 2.242 . . . . 0.0 105.958 177.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -161.73 102.88 1.18 Allowed 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -137.82 151.9 48.57 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.647 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -94.6 123.09 37.83 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 170.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' THR . . . . . 0.458 HG23 ' HB2' ' A' ' 402' ' ' TRP . 11.7 p -83.45 38.12 0.6 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -170.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -75.64 -23.74 56.37 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.89 0.853 . . . . 0.0 109.079 175.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -88.48 -0.78 57.58 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.541 -177.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -99.71 131.5 24.58 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.826 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -69.18 162.76 40.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.73 1.62 . . . . 0.0 108.965 172.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -80.45 -7.23 59.07 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.068 -0.395 . . . . 0.0 110.849 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 56.4 mtpt -126.97 126.95 44.06 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.996 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 64.2 mt -113.26 148.46 35.52 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.881 177.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.38 122.8 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 -173.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' MET . . . . . 0.441 ' HB2' ' HB3' ' A' ' 408' ' ' TRP . 79.9 mtp -100.14 118.5 36.61 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.642 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -110.81 113.87 26.79 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.1 mt -76.49 127.25 32.47 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 31.3 pt -136.59 161.6 60.98 Favored Pre-proline 0 C--N 1.309 -1.177 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.42 128.85 15.02 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 CA-C-N 120.109 1.075 . . . . 0.0 111.569 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -62.97 -26.35 68.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.164 0.986 . . . . 0.0 110.698 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -57.48 -38.63 74.83 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.649 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 63.9 mt -87.06 -2.06 58.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.954 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.8 tt -72.78 -24.19 60.9 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.302 0.641 . . . . 0.0 111.284 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.5 m -57.03 -31.51 65.23 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.675 0.79 . . . . 0.0 112.045 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.8 m -71.86 -18.04 62.09 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 121.3 0.571 . . . . 0.0 111.951 -177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.18 0.85 52.68 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.851 -0.531 . . . . 0.0 111.539 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . 0.41 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -39.7 -52.32 3.12 Favored Glycine 0 CA--C 1.551 2.288 0 CA-C-N 114.4 -1.273 . . . . 0.0 115.355 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 6.8 Cg_endo -50.25 -33.17 35.45 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.534 2.823 . . . . 0.0 114.021 178.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.64 -38.42 65.02 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 110.18 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -69.04 -13.62 62.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.537 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.23 -11.61 59.61 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.568 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.17 92.05 2.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.277 1.037 . . . . 0.0 108.995 171.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 61.7 m -148.14 169.86 19.08 Favored 'General case' 0 N--CA 1.422 -1.868 0 CA-C-O 121.987 0.898 . . . . 0.0 111.922 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -111.29 142.16 43.88 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 126.739 2.016 . . . . 0.0 107.384 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' MET . . . . . 0.508 ' CB ' ' HB2' ' A' ' 434' ' ' ASN . 2.7 mmm -97.62 148.84 22.89 Favored 'General case' 0 CA--C 1.483 -1.628 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.673 -173.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 524' ' ' GLY . 21.4 m -138.32 151.6 24.91 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -127.01 128.89 47.06 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -107.77 116.54 32.14 Favored 'General case' 0 C--O 1.271 2.226 0 CA-C-O 121.867 0.841 . . . . 0.0 110.419 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -123.57 122.57 38.52 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 105.898 -1.889 . . . . 0.0 105.898 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 C--N 1.292 -1.919 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -177.953 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.22 -51.53 20.65 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 118.944 0.793 . . . . 0.0 110.929 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 17.9 m -71.27 -47.55 56.28 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -173.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' LEU . . . . . 0.453 ' HB3' ' CE1' ' A' ' 487' ' ' TYR . 8.0 mp -73.87 -19.27 60.77 Favored 'General case' 0 C--O 1.193 -1.878 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.389 -177.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -62.52 -34.43 76.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.621 0.724 . . . . 0.0 109.158 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' GLY . . . . . 0.406 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -69.77 -47.13 50.04 Favored Glycine 0 N--CA 1.438 -1.205 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.872 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -39.21 90.71 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.942 0.897 . . . . 0.0 111.729 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' TYR . . . . . 0.453 ' CE1' ' HB3' ' A' ' 483' ' ' LEU . 6.0 m-30 -61.19 -40.36 93.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.631 0.373 . . . . 0.0 110.369 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -67.13 -38.23 85.2 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.088 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 485' ' ' GLY . 64.0 mt -64.19 -49.51 80.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.08 0.466 . . . . 0.0 110.149 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 15.4 mmt -63.85 -35.5 80.83 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.29 -14.38 81.97 Favored Glycine 0 CA--C 1.527 0.828 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.078 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -84.17 -0.91 53.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.585 0.707 . . . . 0.0 109.676 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.89 29.99 6.99 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.861 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -107.02 161.6 14.59 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 120.945 0.403 . . . . 0.0 111.139 176.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -136.28 160.11 39.71 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -120.49 106.04 1.13 Allowed Glycine 0 N--CA 1.423 -2.221 0 C-N-CA 119.712 -1.233 . . . . 0.0 111.33 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' CYS . . . . . 0.418 ' SG ' HG22 ' A' ' 537' ' ' ILE . 49.9 t -82.88 123.38 29.33 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.95 120.85 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.131 0 CA-C-O 121.477 0.656 . . . . 0.0 110.165 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -107.74 143.48 36.2 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.562 -1.199 . . . . 0.0 108.377 176.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -98.68 129.77 29.34 Favored Pre-proline 0 C--N 1.285 -2.211 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.634 -175.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo . . . . . 0 CA--C 1.542 0.907 0 C-N-CA 122.402 2.068 . . . . 0.0 110.845 172.672 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 N--CA 1.441 -0.924 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 73.86 149.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.986 1.314 . . . . 0.0 109.222 -178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.544 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.5 m -122.38 160.15 24.84 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.041 0 C-N-CA 117.326 -1.75 . . . . 0.0 111.883 -174.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.523 ' HB2' HG12 ' A' ' 526' ' ' ILE . 13.5 tp -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -170.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 43.0 tpp -109.56 114.4 28.0 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 44.8 tp -101.35 123.98 46.3 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.264 0.554 . . . . 0.0 110.037 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 72.7 mt -126.35 148.87 49.5 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.311 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -97.96 130.48 44.81 Favored 'General case' 0 C--N 1.273 -2.72 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.301 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 46.1 t -102.5 109.97 21.77 Favored 'General case' 0 N--CA 1.411 -2.379 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 33.7 p -69.64 -19.81 63.61 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.531 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -65.52 -44.32 87.32 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.037 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -105.85 -9.86 16.97 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.426 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 69.14 28.72 4.9 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.084 0.954 . . . . 0.0 110.737 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -134.62 168.82 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.835 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.022 -175.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -104.67 139.61 39.26 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.203 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 22.9 mmt -124.17 160.31 28.14 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' GLY . . . . . 0.433 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -170.89 153.6 21.13 Favored Glycine 0 N--CA 1.416 -2.634 0 C-N-CA 118.805 -1.664 . . . . 0.0 112.823 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -114.69 140.02 49.19 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 172.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.523 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.0 mt -108.21 107.6 60.35 Favored Pre-proline 0 N--CA 1.427 -1.585 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 33.5 Cg_exo -68.09 133.86 30.05 Favored 'Trans proline' 0 C--O 1.296 3.388 0 C-N-CA 122.441 2.094 . . . . 0.0 112.846 171.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.2 -35.2 68.87 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 113.092 -1.867 . . . . 0.0 106.848 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.11 65.73 0.81 Allowed 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.291 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -66.78 -38.04 85.77 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.59 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 12.2 m -63.81 -41.6 97.85 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 -177.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.42 -42.9 21.48 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.0 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -64.33 -47.47 79.26 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.197 0.199 . . . . 0.0 111.337 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.97 -39.04 82.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.02 -37.64 87.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.368 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -72.41 -47.3 29.2 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.385 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' ILE . . . . . 0.418 HG22 ' SG ' ' A' ' 497' ' ' CYS . 38.9 mm -62.97 -33.92 63.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 122.963 0.505 . . . . 0.0 111.837 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -56.14 -42.08 76.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 122.922 0.489 . . . . 0.0 110.034 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -66.2 -41.56 90.02 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.811 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 71.7 t -60.89 -44.87 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.043 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 90.3 mt -62.4 -45.72 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.84 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 19.0 m -67.48 -36.54 81.32 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.412 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -66.94 -37.03 83.56 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 C--O 1.224 -0.279 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.795 174.928 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 26.1 ptm . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 47.4 t 68.74 -50.87 0.58 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.515 1.526 . . . . 0.0 113.33 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 89.3 t -67.36 103.74 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 C-N-CA 123.32 0.648 . . . . 0.0 110.458 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 9.7 t -141.62 -15.23 0.83 Allowed 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.697 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -76.25 -51.03 12.87 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.478 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -145.23 135.55 24.07 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.825 178.478 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . 0.418 HD11 ' N ' ' A' ' 399' ' ' LEU . 2.9 mp -102.03 134.52 45.12 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -174.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.77 124.72 27.76 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.03 -41.24 2.77 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.451 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 54.9 t90 -148.8 149.71 31.82 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -173.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.6 m -138.98 117.67 12.24 Favored 'General case' 0 C--N 1.275 -2.643 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.451 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -160.58 -172.46 27.87 Favored Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.8 t -108.98 142.11 22.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -175.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.447 ' HG ' ' SG ' ' A' ' 429' ' ' CYS . 86.0 mt -113.12 141.46 46.88 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.482 ' OE2' ' HG2' ' A' ' 447' ' ' LYS . 35.8 mt-10 -116.04 125.18 52.1 Favored 'General case' 0 N--CA 1.405 -2.688 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 174.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 64.9 p-90 -117.4 139.49 50.81 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.452 -173.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -110.59 136.62 49.41 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.89 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -78.97 -30.71 44.61 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.588 177.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . 0.415 ' HB3' ' HG2' ' A' ' 422' ' ' LYS 0.304 17.0 ttpt -150.4 109.63 3.18 Favored Pre-proline 0 C--N 1.295 -1.768 0 N-CA-C 104.586 -2.375 . . . . 0.0 104.586 -165.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -94.29 -31.42 0.06 OUTLIER 'Trans proline' 0 CA--C 1.539 0.734 0 N-CA-C 118.754 2.559 . . . . 0.0 118.754 -165.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -55.94 114.06 6.84 Favored Pre-proline 0 C--O 1.243 0.741 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -167.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.37 103.79 1.44 Allowed 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 122.864 2.376 . . . . 0.0 107.122 170.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -92.56 1.68 57.12 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -169.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 33.1 m 71.16 -49.58 0.68 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.418 1.087 . . . . 0.0 111.678 -178.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 26.8 m -70.91 -16.65 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 171.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . 0.451 ' OD2' ' HA ' ' A' ' 421' ' ' THR . 28.8 t70 -110.13 89.92 3.16 Favored 'General case' 0 N--CA 1.426 -1.657 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 172.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -78.85 -38.24 38.4 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.987 -177.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -89.8 84.13 6.24 Favored 'General case' 0 CA--C 1.491 -1.304 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 421' ' ' THR . . . . . 0.451 ' HA ' ' OD2' ' A' ' 418' ' ' ASP . 64.7 m -73.27 82.9 1.37 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.03 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . 0.499 ' HD2' ' N ' ' A' ' 422' ' ' LYS . 10.1 mptt 57.2 -175.88 0.06 Allowed 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.363 -1.744 . . . . 0.0 113.744 172.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 91.4 mt -103.32 133.38 48.48 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.97 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 17.0 m -106.46 139.56 40.75 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 38.1 mmt180 -120.49 146.37 46.33 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.003 179.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 27.7 p -108.89 144.84 36.28 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 123.635 0.584 . . . . 0.0 110.987 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 20.9 tp -146.97 126.89 6.7 Favored Pre-proline 0 C--N 1.305 -1.363 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.97 142.05 24.59 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.396 2.064 . . . . 0.0 112.17 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . 0.447 ' SG ' ' HG ' ' A' ' 406' ' ' LEU . 26.0 p -144.29 163.49 33.56 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.376 0.608 . . . . 0.0 111.78 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -117.25 129.18 55.75 Favored 'General case' 0 N--CA 1.423 -1.792 0 N-CA-C 104.404 -2.443 . . . . 0.0 104.404 174.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 48.0 t -117.17 125.29 73.86 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.973 0 CA-C-O 121.794 0.807 . . . . 0.0 110.384 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -108.04 160.98 15.37 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 30.5 m -121.25 141.29 42.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.148 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.588 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 53.8 t30 -94.1 131.31 39.75 Favored 'General case' 1 C--O 1.359 6.855 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 173.952 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -38.43 148.1 0.05 OUTLIER 'General case' 0 C--N 1.363 1.161 3 O-C-N 130.865 5.103 . . . . 0.0 118.987 -161.856 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.51 -18.44 35.34 Favored Glycine 0 CA--C 1.494 -1.273 0 CA-C-N 112.528 -2.124 . . . . 0.0 110.858 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.565 ' OE2' ' HA ' ' A' ' 469' ' ' ARG . 5.6 mm-40 -98.07 118.0 33.69 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 114.329 -0.936 . . . . 0.0 110.806 -170.262 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -108.73 108.45 19.28 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -138.23 156.02 48.08 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -102.39 121.38 42.21 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-O 121.316 0.579 . . . . 0.0 111.034 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -88.71 -13.59 39.29 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -174.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.96 -19.01 65.72 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.567 0.699 . . . . 0.0 109.626 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -82.1 -10.87 59.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.448 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -84.0 141.76 40.99 Favored Pre-proline 0 C--O 1.245 0.864 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -67.31 163.18 35.48 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.567 2.178 . . . . 0.0 109.799 171.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -81.84 -9.93 59.47 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.482 ' HG2' ' OE2' ' A' ' 407' ' ' GLU . 1.8 mptm? -124.47 135.99 53.67 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.915 172.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 56.3 mt -118.5 146.69 44.33 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 59.1 mt -98.82 116.93 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.42 ' HA ' ' O ' ' A' ' 497' ' ' CYS . 22.5 ptm -122.87 134.32 54.39 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.429 0.633 . . . . 0.0 112.186 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -116.71 133.82 55.55 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.52 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -81.58 110.37 16.89 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.296 0.569 . . . . 0.0 110.013 177.307 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 2.4 pp -118.4 152.95 51.59 Favored Pre-proline 0 C--N 1.301 -1.519 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.713 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.96 128.69 20.24 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 121.032 1.155 . . . . 0.0 113.159 -177.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.27 -25.88 68.52 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.137 1.375 . . . . 0.0 110.595 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -57.28 -41.16 79.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.461 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 8.3 mp -85.88 -8.89 57.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.984 0.421 . . . . 0.0 111.219 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.49 -20.0 55.01 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.201 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 11.4 m -57.52 -28.72 63.74 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.015 0.926 . . . . 0.0 110.489 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.55 -22.42 65.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.094 -177.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.59 9.64 42.8 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.653 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -42.7 -55.89 4.49 Favored Glycine 0 CA--C 1.543 1.835 0 N-CA-C 116.31 1.284 . . . . 0.0 116.31 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.75 -19.79 59.22 Favored 'Trans proline' 0 C--N 1.362 1.289 0 CA-C-N 120.122 1.961 . . . . 0.0 113.17 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.22 -22.37 55.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.358 0.599 . . . . 0.0 109.997 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.0 -13.54 61.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.957 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -72.61 -9.87 59.12 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.53 81.29 1.88 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.155 0.978 . . . . 0.0 110.164 173.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' SER . . . . . 0.413 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 51.8 m -155.35 169.42 24.26 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.239 -175.345 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.565 ' HA ' ' OE2' ' A' ' 437' ' ' GLU . 0.1 OUTLIER -109.79 141.72 42.04 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -176.941 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.588 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 41.1 mtp -97.7 149.04 22.72 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 113.593 -3.243 . . . . 0.0 111.347 -172.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 11.6 m -135.17 160.58 40.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.371 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -139.77 133.62 30.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.452 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 65.2 m-85 -107.95 125.3 51.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-O 121.628 0.728 . . . . 0.0 110.748 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -121.32 123.2 41.59 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -90.03 143.73 26.52 Favored 'General case' 0 C--N 1.287 -2.139 0 C-N-CA 119.535 -0.866 . . . . 0.0 113.075 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 22.2 m -80.83 99.35 8.25 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.917 -1.883 . . . . 0.0 105.917 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -66.84 78.55 0.12 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.46 ' HG3' ' OD2' ' A' ' 479' ' ' ASP . 0.3 OUTLIER -80.89 -49.32 11.17 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.862 -1.517 . . . . 0.0 107.625 172.395 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . 0.46 ' OD2' ' HG3' ' A' ' 478' ' ' LYS . 0.9 OUTLIER -124.82 95.7 4.61 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.126 -177.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.27 -27.02 68.72 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.077 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -65.6 -40.64 92.9 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.622 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.8 m -66.54 -41.42 88.74 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.36 -48.18 80.92 Favored 'General case' 0 C--O 1.201 -1.495 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.777 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.496 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 37.5 ttpt -55.35 -47.03 76.34 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 123.517 0.727 . . . . 0.0 110.868 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -63.24 -43.23 98.84 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . 0.475 HD22 ' SD ' ' A' ' 490' ' ' MET . 9.5 tt -66.28 -38.58 88.11 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 123.19 0.596 . . . . 0.0 110.91 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -56.55 -41.39 76.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.172 0.589 . . . . 0.0 110.714 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . 0.496 ' HG2' ' O ' ' A' ' 484' ' ' LYS . 24.8 mmt180 -60.97 -47.26 87.28 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 75.9 mt -68.44 -52.8 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.981 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' MET . . . . . 0.475 ' SD ' HD22 ' A' ' 486' ' ' LEU . 87.3 mtp -76.18 -23.1 54.7 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.046 -0.662 . . . . 0.0 112.184 -175.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -81.41 -12.1 82.41 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.085 -0.578 . . . . 0.0 111.737 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -92.75 3.8 54.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.67 0.748 . . . . 0.0 110.008 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.93 30.15 6.54 Favored Glycine 0 N--CA 1.435 -1.4 0 C-N-CA 119.63 -1.271 . . . . 0.0 113.159 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -104.71 141.0 37.24 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 170.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . 0.401 ' HB3' ' SD ' ' A' ' 512' ' ' MET . . . -118.54 147.91 43.19 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -178.633 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -104.12 104.88 2.51 Favored Glycine 0 N--CA 1.421 -2.352 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . 0.451 ' SG ' HG13 ' A' ' 537' ' ' ILE . 42.1 t -82.88 119.83 24.89 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.335 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.5 t -101.25 121.17 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.645 -175.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -109.01 137.94 46.13 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . 0.458 ' HD2' ' O ' ' A' ' 509' ' ' ARG . 95.5 m-85 -92.49 133.82 29.05 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.62 160.18 12.25 Favored 'Trans proline' 0 C--O 1.25 1.087 0 C-N-CA 122.156 1.904 . . . . 0.0 110.604 172.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -76.14 127.83 33.73 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 121.46 0.648 . . . . 0.0 110.227 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 7.0 t -158.49 -38.58 0.06 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -83.78 153.68 64.34 Favored Pre-proline 0 N--CA 1.441 -0.919 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -47.83 -32.81 18.03 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 124.364 3.376 . . . . 0.0 116.39 -173.646 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 27.6 m -104.29 -75.24 0.62 Allowed 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.867 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -168.77 26.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . 0.403 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 31.6 t 67.35 -97.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.377 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.458 ' O ' ' HD2' ' A' ' 500' ' ' PHE . 96.8 mtt180 -169.76 -176.95 2.52 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.193 -3.262 . . . . 0.0 102.193 -174.751 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.572 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.8 m -134.93 155.97 39.04 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.749 0 CA-C-N 120.832 1.651 . . . . 0.0 111.235 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 40.6 tp -125.52 148.84 48.74 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-O 120.899 0.38 . . . . 0.0 111.609 -172.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' MET . . . . . 0.407 ' O ' ' HA2' ' A' ' 524' ' ' GLY . 39.0 tpp -113.78 138.76 49.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 175.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . 0.434 HD21 ' HE2' ' A' ' 490' ' ' MET . 0.9 OUTLIER -117.5 124.84 49.73 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.072 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.41 139.81 50.59 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 123.605 0.762 . . . . 0.0 109.588 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -94.27 122.94 37.33 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.926 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.9 p -105.83 110.62 22.98 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 12.4 m -68.45 -32.11 71.89 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.391 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -63.24 -41.52 99.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.845 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -94.09 -5.91 46.25 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.9 tptt 62.55 21.36 12.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.402 1.481 . . . . 0.0 110.512 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.06 167.77 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.868 -173.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . 0.452 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 61.3 m-85 -96.46 139.41 32.6 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -128.39 165.9 19.72 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -177.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.407 ' HA2' ' O ' ' A' ' 512' ' ' MET . . . -178.39 153.7 13.32 Favored Glycine 0 N--CA 1.426 -2.01 0 C-N-CA 119.353 -1.403 . . . . 0.0 112.545 175.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.465 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 8.5 mp -115.19 140.04 49.42 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 122.344 0.258 . . . . 0.0 110.429 174.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.572 HG13 ' O ' ' A' ' 510' ' ' VAL . 3.0 tt -109.21 108.11 60.12 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-O 120.899 0.381 . . . . 0.0 111.903 177.096 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 31.8 Cg_exo -69.86 140.35 42.1 Favored 'Trans proline' 0 C--O 1.283 2.766 0 C-N-CA 123.637 2.891 . . . . 0.0 112.764 171.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -70.64 -44.78 66.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 113.555 -1.657 . . . . 0.0 110.316 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -85.16 101.88 12.83 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.575 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -31.98 72.59 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.956 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 18.5 m -59.3 -48.3 82.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.8 -40.36 37.01 Favored Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.179 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.491 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 34.3 t80 -70.59 -46.82 62.7 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.647 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.97 -38.89 81.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -57.54 -46.07 84.31 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.461 0.304 . . . . 0.0 110.352 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . 0.402 ' O ' HG22 ' A' ' 540' ' ' VAL . . . -64.6 -42.05 97.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.644 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.473 ' O ' HG13 ' A' ' 541' ' ' ILE . 48.2 mm -66.88 -35.82 75.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 122.12 0.168 . . . . 0.0 110.945 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.1 -41.35 75.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.956 0.503 . . . . 0.0 110.144 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -63.0 -45.82 90.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.655 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.402 HG22 ' O ' ' A' ' 536' ' ' GLY . 55.7 t -62.4 -45.9 97.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.34 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.473 HG13 ' O ' ' A' ' 537' ' ' ILE . 66.7 mt -65.44 -45.43 92.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 C-N-CA 122.343 0.257 . . . . 0.0 111.42 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.6 t -67.22 -35.73 80.2 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.949 -178.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -67.73 -42.16 82.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.195 0.521 . . . . 0.0 109.787 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.28 -38.92 92.76 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.67 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -70.67 -38.11 73.73 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 176.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.76 -39.51 91.13 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -71.93 -58.79 3.15 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 51.83 86.81 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.671 1.988 . . . . 0.0 112.742 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 38.7 t60 -115.98 32.01 6.37 Favored 'General case' 0 C--N 1.307 -1.245 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 51.0 m-70 -101.53 156.12 17.67 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.405 -1.271 . . . . 0.0 108.033 -178.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 71.7 m80 . . . . . 0 C--N 1.29 -1.996 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 178.887 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 CA--C 1.503 -0.846 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 36.9 m -90.18 14.44 12.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.233 0.539 . . . . 0.0 111.728 -177.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 19.6 m -91.75 81.83 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-O 122.156 0.979 . . . . 0.0 109.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 16.2 m -102.54 -7.69 21.65 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.997 -174.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -130.58 -53.89 1.08 Allowed 'General case' 0 CA--C 1.496 -1.119 0 CA-C-O 121.217 0.532 . . . . 0.0 109.576 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.497 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -128.35 132.72 48.57 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 178.112 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.94 118.48 36.92 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.281 -175.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.53 126.36 27.62 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 176.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -132.55 -46.0 0.89 Allowed 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.446 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 61.4 t90 -147.81 143.42 27.47 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.376 -176.096 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 43.8 t -127.44 118.05 23.31 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.446 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -163.07 -172.51 30.65 Favored Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.968 -175.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.525 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 53.3 t -113.28 141.4 29.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.304 0.642 . . . . 0.0 109.354 -176.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.549 HD12 ' SG ' ' A' ' 429' ' ' CYS . 10.9 mp -114.08 140.54 48.39 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.081 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.475 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 69.0 mt-10 -115.61 126.05 53.7 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.606 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -122.74 153.66 39.17 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.483 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -100.94 138.75 37.58 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.114 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.79 -7.53 34.96 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.318 1.047 . . . . 0.0 110.885 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 56.2 tptt 64.43 86.67 0.13 Allowed Pre-proline 0 N--CA 1.453 -0.292 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -169.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.69 108.23 0.11 Allowed 'Trans proline' 0 C--O 1.245 0.841 0 C-N-CA 124.627 3.551 . . . . 0.0 115.86 -170.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.24 93.64 23.0 Favored Pre-proline 0 C--N 1.298 -1.644 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 171.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.62 112.28 1.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.95 1.767 . . . . 0.0 111.194 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -75.86 -3.05 33.06 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.902 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 25.5 m 74.31 16.44 3.38 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.906 1.282 . . . . 0.0 111.815 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 52.3 t -83.33 -35.7 12.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 173.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -120.22 151.78 38.65 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 104.794 -2.298 . . . . 0.0 104.794 174.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -71.39 -37.69 71.55 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 118.278 0.49 . . . . 0.0 112.112 -176.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -150.63 123.89 8.89 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.606 0.717 . . . . 0.0 110.765 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 4.9 t -138.41 107.52 6.05 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.418 0.628 . . . . 0.0 111.044 -173.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -104.15 82.77 2.0 Allowed 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 53.4 tp -78.84 118.53 20.97 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.269 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 3.4 m -106.61 139.85 40.4 Favored 'General case' 0 N--CA 1.419 -1.981 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . 0.449 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 15.4 mmm180 -114.22 145.73 41.32 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.493 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.475 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 5.4 p -122.42 133.39 54.62 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.259 0.349 . . . . 0.0 110.825 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 95.0 mt -133.54 126.22 19.0 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.191 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.62 135.2 14.35 Favored 'Trans proline' 0 C--O 1.249 1.053 0 C-N-CA 122.263 1.975 . . . . 0.0 110.941 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . 0.566 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 20.8 p -143.21 167.02 23.1 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.336 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -117.13 129.64 56.1 Favored 'General case' 0 N--CA 1.413 -2.29 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 47.7 t -112.16 122.61 66.76 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-O 122.431 1.11 . . . . 0.0 109.958 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -108.72 160.22 16.13 Favored 'General case' 0 N--CA 1.397 -3.078 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 25.8 m -120.87 140.75 44.04 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.026 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.269 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.464 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 25.7 t-20 -95.72 131.03 42.43 Favored 'General case' 1 C--O 1.326 5.094 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.712 179.011 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -27.56 131.51 0.04 OUTLIER 'General case' 0 C--O 1.244 0.808 0 O-C-N 127.288 2.867 . . . . 0.0 113.576 -170.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 111.02 -3.11 28.56 Favored Glycine 0 N--CA 1.421 -2.302 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 -173.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.481 ' OE1' ' HB2' ' A' ' 469' ' ' ARG . 12.7 tt0 -115.87 111.89 21.12 Favored 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 173.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -136.44 97.68 3.64 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -139.19 157.88 45.15 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . 0.42 ' C ' ' H ' ' A' ' 442' ' ' GLU . 52.4 tttm -90.42 108.0 19.5 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -74.43 31.42 0.09 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.382 1.073 . . . . 0.0 112.973 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . 0.42 ' H ' ' C ' ' A' ' 440' ' ' LYS . 36.5 tt0 -66.98 -46.83 73.43 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.628 1.171 . . . . 0.0 112.721 -174.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -92.88 15.23 15.28 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.876 0.37 . . . . 0.0 111.452 -176.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 8.4 m0 -76.79 129.53 78.78 Favored Pre-proline 0 C--N 1.311 -1.072 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.74 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -70.96 163.54 38.88 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.45 2.1 . . . . 0.0 109.762 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -85.68 -6.08 59.18 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.525 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 93.8 mttt -127.73 132.79 49.55 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.5 mt -118.8 146.19 45.02 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.214 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.3 128.24 55.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 80.6 mtp -100.75 125.39 47.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.262 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -107.97 113.54 26.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 7.9 mp -85.35 124.74 32.31 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.246 0.546 . . . . 0.0 111.587 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.5 pt -134.5 161.04 66.08 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.456 -177.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -72.04 128.68 14.26 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 120.064 1.059 . . . . 0.0 112.518 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -63.7 -30.36 71.47 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.623 1.169 . . . . 0.0 110.553 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.08 -36.13 82.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.892 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 34.1 tp -87.29 -5.55 58.88 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.632 0.73 . . . . 0.0 111.022 -176.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 59.1 tp -78.01 -16.12 58.36 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.791 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 22.5 p -57.59 -29.21 64.28 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 124.101 0.96 . . . . 0.0 113.101 -174.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 21.4 m -63.18 -29.75 71.04 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-O 121.102 0.477 . . . . 0.0 110.757 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.14 7.92 29.36 Favored 'General case' 0 C--O 1.222 -0.391 0 O-C-N 122.193 -0.317 . . . . 0.0 111.55 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -46.1 -58.03 5.91 Favored Glycine 0 CA--C 1.543 1.792 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.9 -22.84 75.49 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 122.672 2.248 . . . . 0.0 113.336 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.8 tp -72.43 -29.87 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.016 0.436 . . . . 0.0 109.899 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -75.22 -13.19 60.43 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.297 -0.865 . . . . 0.0 113.073 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . 0.451 ' NE ' ' HA ' ' A' ' 466' ' ' ARG . 5.0 mmp_? -61.78 -46.2 90.6 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.106 -0.638 . . . . 0.0 111.946 -177.376 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -95.13 84.29 4.06 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.0 m -148.24 169.99 18.86 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.922 179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.481 ' HB2' ' OE1' ' A' ' 437' ' ' GLU . 8.0 mtm180 -111.13 141.98 43.92 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 -175.742 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.512 ' HG2' ' HG ' ' A' ' 525' ' ' LEU . 47.5 mtp -99.73 152.71 19.79 Favored 'General case' 0 N--CA 1.425 -1.717 0 C-N-CA 116.837 -1.945 . . . . 0.0 110.75 -173.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.539 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 23.1 m -134.0 159.45 42.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.661 178.031 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -129.44 119.87 24.52 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.752 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -107.42 119.87 40.61 Favored 'General case' 0 C--O 1.29 3.199 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.296 -177.684 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.23 123.22 27.97 Favored 'General case' 0 N--CA 1.42 -1.96 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 174.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 41.2 m-85 -78.49 144.14 36.0 Favored 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.002 -176.471 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 7.1 m -52.47 -41.5 63.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.816 1.246 . . . . 0.0 109.558 -177.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . 0.528 ' C ' ' H ' ' A' ' 479' ' ' ASP . 14.0 m-80 -127.7 142.7 51.26 Favored 'General case' 0 CA--C 1.43 -3.65 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 168.666 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.562 ' O ' ' HB2' ' A' ' 483' ' ' LEU . 58.0 mtpt -65.12 -2.37 2.8 Favored 'General case' 0 C--N 1.291 -1.941 0 O-C-N 124.06 0.85 . . . . 0.0 110.116 173.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . 0.528 ' H ' ' C ' ' A' ' 477' ' ' ASN . 2.3 t70 45.78 66.27 0.97 Allowed 'General case' 0 CA--C 1.43 -3.637 0 C-N-CA 127.95 2.5 . . . . 0.0 107.938 176.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 484' ' ' LYS . 20.0 mt -46.96 -41.29 15.9 Favored 'General case' 0 C--N 1.275 -2.648 0 CA-C-N 110.944 -2.844 . . . . 0.0 112.963 -168.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -72.23 -53.79 11.53 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.035 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 7.0 m -73.88 -47.94 34.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -172.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.562 ' HB2' ' O ' ' A' ' 478' ' ' LYS . 30.4 mt -71.07 -22.39 62.12 Favored 'General case' 0 C--O 1.19 -2.029 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -174.96 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.508 ' HB3' ' HZ2' ' A' ' 484' ' ' LYS . 6.4 ttpm? -55.81 -42.65 75.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 175.108 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -70.0 -44.5 61.07 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.13 175.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -41.67 97.23 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . 0.501 ' CE2' ' HB3' ' A' ' 483' ' ' LEU . 7.0 m-30 -56.23 -42.36 77.14 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.393 0.677 . . . . 0.0 109.774 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.29 -48.05 79.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.197 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 68.6 mt -62.2 -50.54 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 123.577 0.548 . . . . 0.0 111.341 -178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 91.6 mmm -63.65 -43.01 98.02 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.363 0.601 . . . . 0.0 110.427 -177.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -70.34 -12.8 69.88 Favored Glycine 0 CA--C 1.521 0.464 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.685 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -88.5 11.04 18.18 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.287 1.041 . . . . 0.0 109.201 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.91 30.07 6.94 Favored Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.106 177.205 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -113.38 145.16 41.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 117.098 0.449 . . . . 0.0 111.367 176.217 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -124.46 153.47 41.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -114.16 107.39 1.85 Allowed Glycine 0 N--CA 1.422 -2.24 0 C-N-CA 120.34 -0.933 . . . . 0.0 111.204 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 49.5 t -82.42 121.04 26.21 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.0 t -100.8 120.8 50.79 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.197 0 CA-C-O 121.687 0.756 . . . . 0.0 109.588 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -107.6 143.23 36.35 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.84 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -100.19 129.26 28.57 Favored Pre-proline 0 C--N 1.284 -2.268 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.61 -176.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -60.87 134.88 56.09 Favored 'Trans proline' 0 C--O 1.245 0.858 0 N-CA-C 107.19 -1.889 . . . . 0.0 107.19 169.175 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -78.28 114.15 16.91 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 118.5 -1.28 . . . . 0.0 113.373 -173.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 21.0 m -111.72 -36.46 5.45 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.98 117.37 68.64 Favored Pre-proline 0 N--CA 1.429 -1.514 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 169.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -83.06 -2.03 10.61 Favored 'Trans proline' 0 C--N 1.328 -0.541 0 C-N-CA 122.407 2.071 . . . . 0.0 114.192 -177.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 59.8 m -111.79 -78.42 0.58 Allowed 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -121.28 117.45 27.05 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 120.959 0.409 . . . . 0.0 109.913 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.64 -31.45 2.27 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.443 ' HG2' ' HA ' ' A' ' 528' ' ' TYR . 4.7 mtm180 72.69 165.47 0.29 Allowed 'General case' 0 C--N 1.373 1.612 0 C-N-CA 124.853 1.261 . . . . 0.0 109.071 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.552 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 15.9 m -128.63 163.92 32.0 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.945 0 C-N-CA 117.766 -1.574 . . . . 0.0 111.404 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.545 ' HB2' HG12 ' A' ' 526' ' ' ILE . 12.3 tp -125.88 145.87 50.07 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.279 0.561 . . . . 0.0 112.346 -173.206 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 38.5 tpp -115.24 117.81 31.55 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 174.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 48.3 tp -100.03 121.17 40.96 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 121.239 0.542 . . . . 0.0 109.995 -178.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.17 130.02 51.81 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.45 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -90.13 127.45 36.1 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.8 p -101.46 110.76 22.81 Favored 'General case' 0 N--CA 1.401 -2.876 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 7.9 m -68.5 -34.36 75.76 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.197 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -74.46 -27.9 60.8 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.743 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -99.0 -9.89 23.37 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 120.461 -0.496 . . . . 0.0 109.861 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 59.74 31.01 20.59 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.467 1.107 . . . . 0.0 111.797 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -144.82 167.48 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -176.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -102.56 138.33 39.61 Favored 'General case' 0 N--CA 1.42 -1.936 0 C-N-CA 119.321 -0.952 . . . . 0.0 110.283 -179.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 25.8 ptm -127.01 159.57 33.73 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -165.89 153.08 22.79 Favored Glycine 0 N--CA 1.42 -2.38 0 C-N-CA 118.437 -1.839 . . . . 0.0 112.67 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.512 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 9.6 mp -115.58 139.21 50.3 Favored 'General case' 0 C--N 1.29 -1.987 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 171.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.545 HG12 ' HB2' ' A' ' 511' ' ' LEU . 25.0 mt -105.67 107.46 59.41 Favored Pre-proline 0 N--CA 1.428 -1.558 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.552 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 25.4 Cg_exo -70.93 138.0 33.2 Favored 'Trans proline' 0 C--O 1.295 3.359 0 C-N-CA 123.027 2.485 . . . . 0.0 112.316 171.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . 0.443 ' HA ' ' HG2' ' A' ' 509' ' ' ARG . 96.9 m-85 -71.65 -41.43 68.79 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 113.3 -1.773 . . . . 0.0 110.28 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.48 89.71 3.84 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -67.5 -44.98 77.18 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.71 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.1 m -60.36 -46.85 88.47 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 112.818 0.674 . . . . 0.0 112.818 -174.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -75.85 -38.48 36.18 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.453 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.53 ' O ' HG12 ' A' ' 537' ' ' ILE . 46.4 t80 -63.98 -47.57 79.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 93.5 t -61.45 -38.85 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 121.09 0.471 . . . . 0.0 110.038 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -62.44 -41.18 98.55 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.352 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.99 -41.15 93.37 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.53 HG12 ' O ' ' A' ' 533' ' ' PHE . 46.7 mm -62.72 -35.52 71.05 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 122.757 0.423 . . . . 0.0 111.122 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -55.92 -38.59 70.46 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.05 0.452 . . . . 0.0 111.301 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -68.99 -44.27 73.2 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.301 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 48.6 t -62.39 -42.26 94.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.176 179.728 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.432 ' O ' ' HG2' ' A' ' 545' ' ' GLU . 73.8 mt -60.54 -45.14 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.328 0.651 . . . . 0.0 109.708 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 60.2 m -58.7 -41.53 86.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.112 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -68.11 -42.93 79.53 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.455 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.12 -37.76 81.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.659 0.784 . . . . 0.0 111.726 -179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . 0.432 ' HG2' ' O ' ' A' ' 541' ' ' ILE . 79.7 mm-40 -58.06 -32.88 68.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.102 0.477 . . . . 0.0 111.357 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -96.39 -20.91 18.1 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.854 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 38.3 m80 65.63 174.73 0.22 Allowed 'General case' 0 C--O 1.249 1.076 0 C-N-CA 124.774 1.23 . . . . 0.0 110.474 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 44.5 m80 -81.9 77.9 8.67 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 174.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 55.1 p-80 -96.04 14.71 22.84 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.426 -174.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -146.69 -56.31 0.26 Allowed 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.2 p80 . . . . . 0 C--N 1.296 -1.754 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.602 179.816 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 43.0 tpp . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 120.564 0.221 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 29.9 t -126.12 116.74 21.84 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . 0.405 HG11 ' H ' ' A' ' 397' ' ' ASN . 7.6 p -142.01 -32.97 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.205 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 21.1 t 62.78 38.8 11.45 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . 0.405 ' H ' HG11 ' A' ' 395' ' ' VAL . 3.2 p-10 -69.0 147.48 51.53 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.273 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.475 ' HD2' ' N ' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -127.93 153.66 46.43 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.647 -174.379 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 2.9 mp -106.16 132.47 52.19 Favored 'General case' 0 C--N 1.265 -3.091 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -175.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.58 128.87 37.59 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -118.59 -62.88 1.48 Allowed 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.468 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 52.1 t90 -140.11 145.95 38.25 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.357 -171.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 20.6 t -126.26 121.52 32.91 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.468 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -169.56 -172.09 35.82 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.443 -175.131 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.411 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 49.7 t -109.55 139.23 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.411 HD11 ' HB2' ' A' ' 448' ' ' LEU . 9.2 tp -113.91 132.2 56.01 Favored 'General case' 0 N--CA 1.409 -2.514 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -115.62 125.85 53.44 Favored 'General case' 0 N--CA 1.419 -2.012 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 -132.18 145.89 51.66 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 121.04 0.447 . . . . 0.0 111.143 -171.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -101.21 131.61 47.12 Favored 'General case' 0 N--CA 1.42 -1.954 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -78.96 -31.8 45.13 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.587 -177.528 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . 0.424 ' HE2' ' HG ' ' A' ' 416' ' ' SER . 24.7 mtpp -94.47 116.45 66.41 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.706 -177.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.41 -25.34 78.2 Favored 'Trans proline' 0 N--CA 1.485 0.996 0 C-N-CA 123.218 2.612 . . . . 0.0 113.773 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . 0.419 ' HD3' ' O ' ' A' ' 544' ' ' LEU . 22.1 pttm -146.48 150.24 39.92 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.52 79.85 2.1 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.951 1.768 . . . . 0.0 111.081 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -99.07 2.94 46.58 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.68 -1.145 . . . . 0.0 108.613 178.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 416' ' ' SER . . . . . 0.424 ' HG ' ' HE2' ' A' ' 411' ' ' LYS . 58.5 m -53.6 116.8 2.67 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -175.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 21.4 t -118.84 17.81 6.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 102.757 -3.053 . . . . 0.0 102.757 166.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . 0.422 ' OD2' ' HA ' ' A' ' 416' ' ' SER . 2.9 p30 -107.7 137.35 45.87 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 112.405 -2.18 . . . . 0.0 111.628 -176.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.62 -28.88 20.37 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.575 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -65.12 117.61 7.97 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 20.5 m 60.61 90.23 0.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 122.409 1.1 . . . . 0.0 110.945 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.57 6.07 19.83 Favored 'General case' 0 C--N 1.291 -1.945 0 O-C-N 121.625 -0.672 . . . . 0.0 109.397 -178.581 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 90.5 mt -110.69 147.28 34.67 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.815 -177.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 3.6 m -66.35 146.08 54.98 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.332 -1.359 . . . . 0.0 107.332 173.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -91.27 146.66 23.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 46.9 p -125.46 131.53 52.84 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.926 0.393 . . . . 0.0 111.484 -175.115 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . 0.438 HD23 ' HB3' ' A' ' 482' ' ' SER . 62.1 mt -136.16 127.38 16.94 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 122.754 0.422 . . . . 0.0 111.977 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -73.43 134.47 20.74 Favored 'Trans proline' 0 C--O 1.254 1.312 0 C-N-CA 122.385 2.056 . . . . 0.0 110.791 175.222 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.3 p -141.91 161.54 37.71 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.694 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -116.98 129.78 56.26 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.36 124.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.795 0 CA-C-O 121.739 0.78 . . . . 0.0 110.502 -175.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -107.86 155.37 20.35 Favored 'General case' 0 C--N 1.28 -2.428 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 18.1 m -122.27 139.31 49.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.491 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 37.0 t30 -98.33 130.86 45.0 Favored 'General case' 1 C--O 1.309 4.219 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.502 168.703 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 80.0 m80 -19.53 152.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 131.166 3.786 . . . . 0.0 118.201 -170.304 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 110.76 -1.16 28.89 Favored Glycine 0 C--O 1.244 0.769 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.488 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.419 ' CD ' ' H ' ' A' ' 437' ' ' GLU . 0.0 OUTLIER -97.19 146.31 25.2 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -174.063 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -155.95 93.41 1.44 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 160.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -142.26 146.4 35.09 Favored 'General case' 0 C--N 1.281 -2.385 0 CA-C-N 114.09 -1.413 . . . . 0.0 107.539 174.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . 0.499 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 19.4 ptmt -102.25 129.41 48.64 Favored 'General case' 0 C--N 1.282 -2.359 0 C-N-CA 118.665 -1.214 . . . . 0.0 110.185 175.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 8.0 p -83.56 1.15 43.46 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.086 0.946 . . . . 0.0 111.435 -175.758 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.08 -30.12 71.21 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.687 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 440' ' ' LYS . 4.4 pt20 -101.29 17.22 23.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.627 -176.932 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -95.94 141.84 23.73 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.257 177.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.85 163.04 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.187 1.925 . . . . 0.0 109.74 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . 0.308 2.7 pp0? -97.55 -7.78 30.54 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.411 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 14.0 mptt -127.88 113.77 16.33 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.786 0.834 . . . . 0.0 109.67 169.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . 0.411 ' HB2' HD11 ' A' ' 406' ' ' LEU . 50.3 mt -103.38 147.12 27.5 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 46.5 mm -99.35 122.52 51.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 120.887 0.375 . . . . 0.0 110.543 -174.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.418 ' SD ' HD21 ' A' ' 513' ' ' LEU . 57.9 ttp -112.08 121.82 46.04 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . 0.441 ' HB2' ' SG ' ' A' ' 497' ' ' CYS . 12.4 mm-40 -106.91 133.62 51.29 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 88.1 mt -91.29 115.87 28.37 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.473 0.654 . . . . 0.0 111.391 -177.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 39.6 pt -116.9 161.76 30.79 Favored Pre-proline 0 C--N 1.311 -1.077 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.078 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_exo -71.54 129.68 16.09 Favored 'Trans proline' 0 C--O 1.244 0.806 0 C-N-CA 121.464 1.443 . . . . 0.0 110.919 179.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -62.75 -28.15 69.77 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.5 0.72 . . . . 0.0 111.148 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 19.3 mp0 -63.89 -40.7 97.13 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.132 -176.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.8 mt -77.81 -11.47 59.89 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.198 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.1 tp -82.69 -19.33 38.32 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.0 m -58.28 -28.55 65.06 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 122.959 0.503 . . . . 0.0 111.134 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 15.7 m -61.37 -27.62 68.65 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.195 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.07 8.42 37.86 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.628 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . 0.424 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -45.96 -52.25 10.08 Favored Glycine 0 CA--C 1.545 1.933 0 N-CA-C 114.891 0.716 . . . . 0.0 114.891 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 11.8 Cg_endo -56.14 -28.62 71.3 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.88 2.387 . . . . 0.0 113.405 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 42.4 tp -75.93 -29.89 58.53 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.202 0.525 . . . . 0.0 110.762 -177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -72.99 -12.61 61.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.183 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -68.83 -20.48 64.31 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.777 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -127.21 84.66 2.28 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.334 0.588 . . . . 0.0 109.482 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.4 m -158.15 170.32 22.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 -178.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -110.45 143.75 40.28 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 124.326 1.051 . . . . 0.0 109.61 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.491 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 32.2 mmm -96.39 152.06 18.95 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -165.522 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 4.8 m -142.27 162.08 19.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -133.84 130.03 37.32 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -110.95 117.62 33.87 Favored 'General case' 0 C--O 1.274 2.389 0 CA-C-O 121.734 0.778 . . . . 0.0 111.015 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -114.51 122.71 47.4 Favored 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 173.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -90.78 150.48 21.58 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.66 -177.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' THR . . . . . 0.403 ' C ' ' H ' ' A' ' 478' ' ' LYS . 77.4 p -82.64 138.64 34.1 Favored 'General case' 0 N--CA 1.418 -2.07 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -76.44 47.9 0.51 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.283 1.04 . . . . 0.0 109.955 177.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.403 ' H ' ' C ' ' A' ' 476' ' ' THR . 22.3 tptm -81.85 -40.37 22.55 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.118 -177.476 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -135.19 90.77 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 79.1 mt -67.4 -24.27 65.65 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -69.53 -42.33 74.79 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.275 0.559 . . . . 0.0 110.865 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' SER . . . . . 0.438 ' HB3' HD23 ' A' ' 427' ' ' LEU . 8.5 t -72.22 -38.35 69.0 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.76 -43.78 97.89 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.276 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -55.04 -43.04 73.4 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.312 0.645 . . . . 0.0 110.587 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.499 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.96 -46.44 59.49 Favored Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 42.4 tp -58.41 -44.3 88.96 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 123.544 0.737 . . . . 0.0 111.267 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -60.35 -40.33 90.34 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 122.654 0.382 . . . . 0.0 111.16 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -66.58 -44.04 83.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.018 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . 0.499 HG13 ' O ' ' A' ' 485' ' ' GLY . 66.2 mt -65.78 -44.4 93.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.159 0.504 . . . . 0.0 109.834 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.4 mmt -63.87 -43.01 97.37 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.041 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.16 -15.36 69.74 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.215 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -84.72 -4.24 58.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.396 0.617 . . . . 0.0 109.891 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.56 30.42 6.54 Favored Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.104 -1.046 . . . . 0.0 113.739 177.353 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -103.4 161.75 13.58 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.64 0.257 . . . . 0.0 110.342 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -127.95 153.12 47.07 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -112.31 107.53 2.07 Favored Glycine 0 N--CA 1.424 -2.152 0 C-N-CA 120.203 -0.998 . . . . 0.0 112.4 -177.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . 0.441 ' SG ' ' HB2' ' A' ' 451' ' ' GLN . 17.6 p -84.44 117.32 23.57 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.13 120.41 50.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.881 0 CA-C-O 121.962 0.887 . . . . 0.0 109.303 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -112.81 143.24 44.39 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 113.145 -1.843 . . . . 0.0 107.763 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . 0.43 ' CD2' HG13 ' A' ' 508' ' ' VAL . 15.8 m-85 -98.68 126.48 38.81 Favored Pre-proline 0 C--N 1.268 -2.969 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 113.38 1.51 Allowed 'Trans proline' 0 C--O 1.244 0.819 0 C-N-CA 122.536 2.157 . . . . 0.0 112.992 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -77.45 124.32 27.73 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 9.4 t 172.32 -25.31 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.826 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -83.84 150.27 58.6 Favored Pre-proline 0 N--CA 1.428 -1.561 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 171.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -76.97 1.94 8.11 Favored 'Trans proline' 0 N--CA 1.478 0.591 0 C-N-CA 122.973 2.448 . . . . 0.0 113.179 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . 0.418 ' HG ' ' NE2' ' A' ' 443' ' ' GLN . 49.7 t -85.06 142.96 29.19 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.426 -178.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -89.95 92.9 9.19 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . 0.43 HG13 ' CD2' ' A' ' 500' ' ' PHE . 4.6 t -88.35 137.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.133 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.609 ' HD2' ' O ' ' A' ' 528' ' ' TYR . 19.4 mmt180 -81.2 171.15 15.23 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.539 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 24.2 m -109.44 165.87 5.12 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.402 0 C-N-CA 117.966 -1.494 . . . . 0.0 112.077 -171.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.58 ' HB2' HG12 ' A' ' 526' ' ' ILE . 1.0 OUTLIER -133.01 134.42 44.42 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.118 -177.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' MET . . . . . 0.415 ' N ' HD21 ' A' ' 511' ' ' LEU . 35.0 tpp -102.46 121.36 42.19 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.011 -0.736 . . . . 0.0 109.011 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . 0.431 HD12 ' HB3' ' A' ' 522' ' ' PHE . 31.8 tp -106.95 125.29 50.81 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.622 0.725 . . . . 0.0 110.523 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 59.4 mt -124.28 148.83 47.12 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.237 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -100.04 124.0 44.92 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.359 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 34.8 p -93.9 110.42 22.09 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 173.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.8 p -68.92 -35.49 76.87 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.352 -1.294 . . . . 0.0 113.061 -175.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -72.92 -24.17 60.78 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.65 0.738 . . . . 0.0 110.327 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -105.24 -9.81 17.45 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.257 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 61.09 24.13 14.26 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.736 1.214 . . . . 0.0 111.598 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -133.0 167.65 26.17 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.687 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . 0.431 ' HB3' HD12 ' A' ' 513' ' ' LEU . 24.4 m-85 -102.31 138.87 38.68 Favored 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.314 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -133.81 141.63 47.53 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.433 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -152.69 159.12 28.27 Favored Glycine 0 N--CA 1.431 -1.663 0 C-N-CA 118.861 -1.637 . . . . 0.0 113.465 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.534 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.6 mp -115.6 139.96 49.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 173.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.58 HG12 ' HB2' ' A' ' 511' ' ' LEU . 12.4 mt -97.97 107.98 43.73 Favored Pre-proline 0 C--O 1.249 1.072 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 177.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.539 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.8 Cg_exo -72.06 133.13 20.85 Favored 'Trans proline' 0 C--O 1.294 3.301 0 C-N-CA 123.231 2.621 . . . . 0.0 112.289 171.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . 0.609 ' O ' ' HD2' ' A' ' 509' ' ' ARG . 70.4 m-85 -74.89 -41.3 60.02 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.571 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -84.03 91.95 7.75 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.944 0.878 . . . . 0.0 110.184 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -37.34 83.13 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 114.201 -1.363 . . . . 0.0 113.138 179.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 22.6 t -61.0 -47.71 85.21 Favored 'General case' 0 C--O 1.243 0.763 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -175.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.68 -36.54 37.22 Favored Glycine 0 N--CA 1.437 -1.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.818 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.45 ' O ' HG12 ' A' ' 537' ' ' ILE . 50.2 t80 -66.22 -47.34 74.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 88.2 t -65.24 -38.36 82.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.052 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -59.17 -38.56 80.06 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.38 0.61 . . . . 0.0 110.187 176.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -70.53 -46.3 48.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 533' ' ' PHE . 51.6 mm -67.33 -36.15 75.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -56.33 -43.19 78.8 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -59.64 -40.45 87.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.647 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 56.5 t -67.28 -46.56 83.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.066 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.492 ' O ' ' HG3' ' A' ' 545' ' ' GLU . 77.0 mt -62.71 -45.25 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-O 121.302 0.572 . . . . 0.0 109.935 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' THR . . . . . 0.452 ' HA ' ' OE1' ' A' ' 545' ' ' GLU . 21.8 m -63.37 -33.56 75.81 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.907 177.332 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -64.63 -44.08 91.66 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 173.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.439 ' HB2' ' O ' ' A' ' 541' ' ' ILE . 96.8 mt -57.66 -35.89 71.15 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.486 0.714 . . . . 0.0 111.733 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . 0.492 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 47.0 mt-10 -65.67 -27.5 68.41 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.079 0.552 . . . . 0.0 111.516 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -97.46 -36.71 10.25 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.406 -177.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -72.88 113.14 9.58 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 124.469 1.108 . . . . 0.0 108.96 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 38.4 m170 -56.34 -74.21 0.05 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.554 0.742 . . . . 0.0 112.206 -177.093 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -144.47 -44.73 0.25 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -154.77 136.12 14.1 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 . . . . . 0 C--N 1.294 -1.806 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 175.597 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 24.8 mmt . . . . . 0 CA--C 1.501 -0.93 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 21.1 m -86.42 80.78 8.56 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 34.1 m -102.22 179.32 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 6.1 m -69.36 -51.88 32.53 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 68.18 -52.3 0.54 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 124.796 1.238 . . . . 0.0 111.029 -177.479 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.464 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -107.61 136.77 46.81 Favored 'General case' 0 N--CA 1.415 -2.18 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 174.778 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mp -112.6 137.05 51.42 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.59 125.14 22.92 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -111.9 -64.65 1.26 Allowed 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.09 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.576 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 69.1 t90 -161.61 150.09 15.53 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -169.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.5 m -129.47 117.82 21.13 Favored 'General case' 0 C--N 1.276 -2.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.576 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -155.1 -172.39 22.73 Favored Glycine 0 N--CA 1.424 -2.15 0 C-N-CA 119.752 -1.213 . . . . 0.0 113.152 -174.389 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 61.6 t -109.28 140.71 26.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.133 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 84.4 mt -113.26 128.14 56.38 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -117.21 126.08 52.2 Favored 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -177.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -126.96 147.95 50.09 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.36 0.664 . . . . 0.0 110.085 -174.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . 0.4 ' HA ' ' HA ' ' A' ' 424' ' ' THR . 45.5 tt0 -99.42 138.95 35.79 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.58 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . 0.427 ' O ' ' HD3' ' A' ' 412' ' ' PRO . 45.3 mt-10 -77.05 112.46 13.71 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 170.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -111.65 96.56 33.14 Favored Pre-proline 0 C--N 1.302 -1.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.406 -176.129 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . 0.427 ' HD3' ' O ' ' A' ' 410' ' ' GLU . 1.0 OUTLIER -87.94 -72.66 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.446 2.097 . . . . 0.0 109.352 172.202 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -174.79 136.9 0.57 Allowed Pre-proline 0 N--CA 1.438 -1.062 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -82.44 113.26 2.29 Favored 'Trans proline' 0 N--CA 1.441 -1.585 0 C-N-CA 121.424 1.416 . . . . 0.0 110.91 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -76.96 -24.2 52.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.582 0.706 . . . . 0.0 110.261 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 14.1 m -115.06 167.37 10.87 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 65.5 t -74.74 100.99 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -136.2 137.83 41.26 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.715 -177.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.38 -38.81 14.79 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.154 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 175.71 83.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.821 1.249 . . . . 0.0 110.178 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 8.9 m -128.79 7.39 5.64 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 171.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . 0.449 ' HA ' ' HE3' ' A' ' 422' ' ' LYS . 0.0 OUTLIER -79.5 152.48 30.19 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 175.785 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 94.4 mt -59.53 113.92 2.45 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.045 0.926 . . . . 0.0 113.04 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' THR . . . . . 0.4 ' HA ' ' HA ' ' A' ' 409' ' ' GLN . 6.8 m -100.53 134.9 42.8 Favored 'General case' 0 N--CA 1.418 -2.057 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 176.672 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -109.73 145.81 35.97 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -175.535 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 56.3 p -123.13 130.1 52.32 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 121.134 -0.226 . . . . 0.0 110.863 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 428' ' ' PRO . 92.5 mt -130.55 125.94 21.78 Favored Pre-proline 0 C--N 1.316 -0.861 0 O-C-N 123.192 0.308 . . . . 0.0 111.094 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 427' ' ' LEU . 8.7 Cg_exo -75.84 142.34 25.29 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.043 2.496 . . . . 0.0 112.182 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 475' ' ' PHE . 23.1 p -141.13 168.57 19.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.2 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -115.7 129.53 56.51 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 104.953 -2.239 . . . . 0.0 104.953 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.8 t -122.79 123.92 69.33 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 CA-C-O 121.874 0.845 . . . . 0.0 110.274 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . 0.439 ' HB2' ' HB3' ' A' ' 472' ' ' GLN . 78.0 m-85 -118.54 161.0 20.75 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.463 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 6.2 m -121.86 140.22 46.5 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.501 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -96.07 132.96 40.9 Favored 'General case' 0 C--O 1.297 3.553 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.267 172.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -25.15 157.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 129.94 3.296 . . . . 0.0 117.385 -171.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.08 -2.43 35.34 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -172.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.522 ' HA ' ' CZ ' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -101.77 161.46 13.64 Favored 'General case' 0 N--CA 1.406 -2.648 0 CA-C-N 113.12 -1.54 . . . . 0.0 114.584 -174.822 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 178.81 94.01 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 168.797 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -142.72 157.56 44.53 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.919 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -99.71 132.0 45.33 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.402 ' HA ' ' CD1' ' A' ' 444' ' ' TRP . 17.7 p -101.74 19.11 18.79 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.235 0.54 . . . . 0.0 111.965 -177.564 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -75.8 -27.53 57.98 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.511 0.672 . . . . 0.0 111.609 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -94.57 8.43 42.28 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.33 1.062 . . . . 0.0 109.855 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . 0.402 ' CD1' ' HA ' ' A' ' 441' ' ' THR . 12.7 m0 -80.18 121.1 81.46 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.468 177.055 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.98 149.47 70.46 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.55 2.167 . . . . 0.0 110.194 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.15 -22.53 59.4 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 123.066 0.546 . . . . 0.0 110.229 -174.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -124.35 123.84 41.08 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.555 173.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 90.2 mt -106.29 146.94 29.75 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 51.4 mm -98.53 119.12 46.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.506 ' SD ' HD21 ' A' ' 513' ' ' LEU . 54.2 ttp -113.33 129.7 56.46 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.347 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 14.8 mm-40 -119.0 130.93 55.94 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 77.9 mt -84.54 123.71 30.6 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.233 -176.489 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 30.9 pt -128.61 158.03 73.24 Favored Pre-proline 0 C--N 1.305 -1.355 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.51 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -63.57 130.15 27.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 121.865 1.71 . . . . 0.0 111.312 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . 0.495 ' O ' ' HB3' ' A' ' 458' ' ' LEU . 21.1 tm0? -62.3 -29.93 70.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.249 0.62 . . . . 0.0 111.667 -177.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -60.27 -31.08 69.89 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -79.29 -12.75 59.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.218 0.533 . . . . 0.0 111.096 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 455' ' ' GLN . 4.2 tt -73.74 -22.18 59.96 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 124.036 0.934 . . . . 0.0 110.938 -178.357 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 41.7 p -58.42 -19.72 38.64 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 14.6 t -70.76 -21.14 62.55 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.279 0.561 . . . . 0.0 110.905 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 86.4 mt -88.62 11.05 18.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.127 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.19 -58.43 5.08 Favored Glycine 0 CA--C 1.548 2.115 0 CA-C-O 119.38 -0.678 . . . . 0.0 114.469 178.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.27 -24.44 78.85 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.899 2.4 . . . . 0.0 112.693 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.0 tp -75.46 -46.44 32.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.223 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -70.69 -14.77 62.58 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -71.95 -17.13 62.1 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.813 0.339 . . . . 0.0 111.054 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -126.78 76.83 1.67 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' SER . . . . . 0.41 ' HA ' ' CE2' ' A' ' 528' ' ' TYR . 69.3 m -152.8 170.99 18.96 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.926 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.522 ' CZ ' ' HA ' ' A' ' 437' ' ' GLU . 6.5 ptp180 -111.69 144.04 41.61 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 125.889 1.676 . . . . 0.0 109.039 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' MET . . . . . . . . . . . . . 27.3 mmm -95.4 152.61 18.24 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.405 -167.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.546 HG21 ' O ' ' A' ' 524' ' ' GLY . 16.8 m -127.14 162.08 32.91 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.275 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . 0.439 ' HB3' ' HB2' ' A' ' 432' ' ' TYR . 55.8 tp60 -133.51 119.95 20.19 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -115.36 126.44 54.43 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-O 121.594 0.711 . . . . 0.0 111.57 -178.212 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.97 123.19 26.86 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 174.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . 0.401 ' HA ' ' HA ' ' A' ' 429' ' ' CYS . 56.4 m-85 -82.98 154.4 24.51 Favored 'General case' 0 C--N 1.294 -1.82 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.83 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 63.1 p -71.72 136.3 47.15 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.787 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -77.55 20.81 0.3 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -67.98 -50.36 56.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 0.0 111.448 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -120.07 83.19 2.01 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.602 0.715 . . . . 0.0 109.916 -175.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.51 -24.76 65.6 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.865 -1.062 . . . . 0.0 111.383 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 484' ' ' LYS . 29.3 mm-40 -71.09 -45.02 64.51 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.9 m -63.87 -37.16 86.36 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.279 0.561 . . . . 0.0 109.527 176.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.522 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 85.2 mt -64.57 -36.8 85.4 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.991 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.42 ' HB3' ' O ' ' A' ' 481' ' ' GLU . 36.9 ttpt -54.44 -44.49 72.53 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.715 0.806 . . . . 0.0 110.649 -178.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -69.3 -43.52 70.13 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.092 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.88 -42.48 97.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.897 0.479 . . . . 0.0 110.081 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . 0.522 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -58.49 -40.41 82.69 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.689 0.396 . . . . 0.0 111.351 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -67.28 -37.68 83.83 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.2 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 65.6 mt -68.24 -45.58 82.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 177.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.1 mmt -63.62 -37.31 86.84 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.529 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.31 -9.95 84.35 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.344 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -92.53 8.52 38.49 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.774 0.797 . . . . 0.0 109.943 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 91.61 29.66 11.74 Favored Glycine 0 C--O 1.245 0.804 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.889 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -109.24 157.03 19.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -128.24 160.51 31.89 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -118.15 109.1 1.74 Allowed Glycine 0 N--CA 1.421 -2.319 0 C-N-CA 120.004 -1.094 . . . . 0.0 111.461 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 19.6 p -82.39 120.55 25.58 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.6 t -102.35 120.2 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.723 0 CA-C-O 121.489 0.661 . . . . 0.0 109.411 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 42.3 m80 -112.01 137.48 49.97 Favored 'General case' 0 N--CA 1.418 -2.044 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.783 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -98.95 114.81 65.83 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.535 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -58.3 107.57 0.34 Allowed 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.153 1.902 . . . . 0.0 108.593 175.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -77.28 115.19 16.85 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 119.249 -0.981 . . . . 0.0 111.003 -174.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 8.8 t -101.53 -22.71 14.44 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.62 175.264 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.38 152.24 60.63 Favored Pre-proline 0 N--CA 1.439 -0.979 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.163 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -81.9 -13.0 10.65 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.381 2.054 . . . . 0.0 112.166 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 24.8 t -95.56 168.74 10.5 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . 0.432 ' HG3' HE21 ' A' ' 530' ' ' GLN . 2.7 mp0 -60.84 101.46 0.15 Allowed 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 124.346 1.059 . . . . 0.0 113.08 -176.12 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 33.6 t -85.62 109.13 18.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 172.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -56.75 150.83 15.28 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 124.268 0.98 . . . . 0.0 110.389 -175.82 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.553 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 12.5 m -118.33 159.03 19.02 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.734 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 6.4 tt -135.35 147.11 48.99 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.119 -1.032 . . . . 0.0 112.747 -167.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 53.2 tpp -106.42 124.62 49.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . 0.506 HD21 ' SD ' ' A' ' 450' ' ' MET . 44.8 tp -104.17 127.31 51.76 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.536 0.684 . . . . 0.0 110.354 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -130.72 148.68 52.54 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.664 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -102.37 129.13 48.75 Favored 'General case' 0 C--N 1.277 -2.548 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 176.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.7 t -104.92 110.7 23.18 Favored 'General case' 0 N--CA 1.414 -2.246 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 11.7 t -69.73 -22.43 63.38 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.165 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -62.66 -43.38 98.96 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.945 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.02 -4.75 24.18 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.306 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 59.99 30.02 19.55 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.616 1.166 . . . . 0.0 111.492 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -140.96 168.71 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.948 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . 0.456 ' HB3' HD12 ' A' ' 513' ' ' LEU . 44.3 m-85 -96.41 139.26 32.78 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -138.05 166.51 23.92 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 123.689 0.796 . . . . 0.0 109.485 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.546 ' O ' HG21 ' A' ' 471' ' ' VAL . . . 178.86 167.29 36.25 Favored Glycine 0 N--CA 1.42 -2.369 0 C-N-CA 119.135 -1.507 . . . . 0.0 111.745 178.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.432 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.1 mp -114.94 140.66 48.83 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 170.373 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.546 HG13 ' O ' ' A' ' 510' ' ' VAL . 6.7 tt -103.38 107.86 57.22 Favored Pre-proline 0 C--N 1.299 -1.599 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.568 175.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.553 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 32.5 Cg_exo -66.33 132.21 28.81 Favored 'Trans proline' 0 C--O 1.282 2.689 0 C-N-CA 123.315 2.677 . . . . 0.0 113.286 172.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . 0.429 ' HE1' ' CZ ' ' A' ' 469' ' ' ARG . 43.3 m-85 -72.26 -38.98 68.73 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 113.175 -1.83 . . . . 0.0 109.094 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.35 87.29 6.6 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.428 -174.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . 0.432 HE21 ' HG3' ' A' ' 507' ' ' GLU . 4.9 pp0? -66.61 -34.53 78.1 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.741 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.8 p -58.92 -46.45 87.91 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.467 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.65 -34.76 52.98 Favored Glycine 0 N--CA 1.429 -1.774 0 CA-C-N 116.292 -0.413 . . . . 0.0 113.254 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.488 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 73.5 t80 -70.54 -47.64 59.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.295 0.548 . . . . 0.0 110.556 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 99.1 t -64.79 -37.82 81.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.002 -179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -59.54 -48.17 82.7 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.58 89.16 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.283 -0.484 . . . . 0.0 112.197 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.419 ' O ' HG13 ' A' ' 541' ' ' ILE . 39.9 mm -68.27 -22.15 27.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.619 -0.291 . . . . 0.0 111.326 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -60.58 -40.44 91.69 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.12 -0.363 . . . . 0.0 110.657 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.81 -38.02 89.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.94 -49.96 77.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.854 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 537' ' ' ILE . 81.8 mt -60.68 -45.96 96.66 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 123.18 0.592 . . . . 0.0 111.676 -178.295 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.7 t -65.93 -38.49 88.79 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.262 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.7 -41.4 79.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.246 176.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.85 -33.69 74.23 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.92 0.488 . . . . 0.0 110.361 -178.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -65.84 -26.59 67.73 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 111.862 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -83.83 -28.78 27.8 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 73.25 156.78 0.18 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.712 2.005 . . . . 0.0 109.711 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . 0.429 ' HB2' ' CE1' ' A' ' 550' ' ' HIS . 3.4 p80 -149.51 102.48 3.19 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -96.68 -40.73 8.85 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . 0.429 ' CE1' ' HB2' ' A' ' 548' ' ' HIS . 40.0 m80 71.49 4.37 5.03 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.167 1.387 . . . . 0.0 112.339 -178.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 32.5 m80 . . . . . 0 C--N 1.309 -1.193 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 176.309 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 111.243 0.09 . . . . 0.0 111.243 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 14.5 m -67.57 -42.18 82.99 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.323 0.582 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 7.5 p -133.09 102.88 5.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-O 122.236 1.017 . . . . 0.0 109.212 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 39.4 m -147.58 -159.37 1.02 Allowed 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -176.277 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 19.7 m120 68.38 -156.44 0.19 Allowed 'General case' 0 C--O 1.254 1.312 0 O-C-N 123.799 0.687 . . . . 0.0 109.764 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.26 147.89 28.61 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-O 121.094 0.473 . . . . 0.0 111.345 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 4.3 mp -101.98 137.66 39.97 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.063 -175.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.25 115.45 7.72 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 175.236 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.66 -54.59 2.47 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.536 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 74.4 t90 -159.45 144.95 15.87 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.187 -171.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 45.7 m -130.0 120.89 25.49 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 174.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.536 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -156.48 -171.67 22.98 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -174.021 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -121.28 142.57 36.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-N 116.909 0.354 . . . . 0.0 110.148 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.654 HD12 ' SG ' ' A' ' 429' ' ' CYS . 9.8 mp -112.76 139.06 48.7 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -115.02 152.43 32.46 Favored 'General case' 0 C--O 1.254 1.34 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . 0.409 ' CD1' ' HE1' ' A' ' 450' ' ' MET . 0.0 OUTLIER -144.15 164.04 31.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.972 1.709 . . . . 0.0 108.997 -178.231 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -115.17 157.59 23.43 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 118.494 0.588 . . . . 0.0 111.012 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . 0.4 ' CD ' ' HE ' ' A' ' 425' ' ' ARG . 12.1 mm-40 -85.14 146.0 27.34 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.09 170.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp 44.48 82.22 0.24 Allowed Pre-proline 0 C--O 1.243 0.726 0 C-N-CA 126.216 1.806 . . . . 0.0 114.146 172.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -58.14 -45.73 29.8 Favored 'Trans proline' 0 C--O 1.241 0.664 0 C-N-CA 122.263 1.975 . . . . 0.0 110.48 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -137.23 100.51 9.48 Favored Pre-proline 0 N--CA 1.442 -0.855 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.254 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -75.26 148.1 33.86 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.17 1.914 . . . . 0.0 111.501 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -79.32 -19.73 49.65 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.624 0.726 . . . . 0.0 109.121 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 18.4 m -87.23 164.11 16.51 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.187 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 30.9 m -78.19 -13.52 13.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.6 0.714 . . . . 0.0 110.347 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -122.46 137.41 54.88 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -75.92 -17.18 59.86 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 123.316 0.385 . . . . 0.0 111.918 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 65.88 -69.17 0.11 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.422 1.489 . . . . 0.0 112.899 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 1.1 p -133.81 84.49 2.13 Favored 'General case' 0 N--CA 1.42 -1.948 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -86.65 79.79 8.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.468 1.128 . . . . 0.0 109.194 174.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 83.9 mt -93.66 152.73 18.79 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.536 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 8.1 m -89.68 131.79 35.49 Favored 'General case' 0 N--CA 1.413 -2.304 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . 0.4 ' HE ' ' CD ' ' A' ' 410' ' ' GLU . 40.0 mmt180 -100.68 145.29 28.62 Favored 'General case' 0 C--N 1.286 -2.168 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 174.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 57.5 p -144.48 159.76 42.22 Favored 'General case' 0 C--N 1.259 -3.357 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.208 179.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 22.6 tp -146.55 117.36 4.72 Favored Pre-proline 0 N--CA 1.412 -2.367 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.51 132.29 23.42 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.61 2.207 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . 0.654 ' SG ' HD12 ' A' ' 406' ' ' LEU . 0.0 OUTLIER -125.8 157.73 36.78 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.011 -175.515 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -116.89 128.92 55.71 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 170.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 28.5 t -120.33 122.98 69.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.899 0 CA-C-O 122.137 0.97 . . . . 0.0 110.218 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.09 155.09 26.61 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.464 HG11 HG11 ' A' ' 471' ' ' VAL . 26.2 m -122.33 140.74 45.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.405 0 C-N-CA 119.739 -0.785 . . . . 0.0 111.264 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.49 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 27.0 t-20 -95.2 132.24 40.37 Favored 'General case' 1 C--O 1.324 4.998 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.337 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -34.35 161.42 0.0 OUTLIER 'General case' 0 C--N 1.361 1.1 0 O-C-N 127.824 3.203 . . . . 0.0 116.66 -171.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 106.59 -3.01 36.61 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -174.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.65 161.9 13.34 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.601 1.16 . . . . 0.0 113.978 -174.699 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -165.25 95.66 0.67 Allowed 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 165.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -140.81 141.49 34.73 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.071 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -96.45 118.2 32.46 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.498 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 43.5 p -81.21 5.19 17.76 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.784 0.802 . . . . 0.0 111.099 -178.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -59.04 -32.0 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.907 1.283 . . . . 0.0 109.943 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -90.81 4.58 51.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.297 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 18.4 m0 -92.78 126.25 52.43 Favored Pre-proline 0 C--N 1.308 -1.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.855 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.19 162.93 33.7 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.303 2.002 . . . . 0.0 110.474 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -75.58 -26.31 57.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 120.836 0.35 . . . . 0.0 111.044 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -113.98 130.95 56.49 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.666 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 39.4 mt -118.84 147.83 43.52 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.206 176.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 58.3 mt -98.33 123.64 50.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.409 ' HE1' ' CD1' ' A' ' 408' ' ' TRP . 65.8 ttp -100.47 132.54 45.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.097 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -124.25 115.91 21.81 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 89.2 mt -88.55 116.25 26.66 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.328 0.585 . . . . 0.0 110.728 -177.122 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.0 pt -119.87 161.66 37.02 Favored Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 125.033 1.333 . . . . 0.0 108.52 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -67.48 129.58 20.46 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 121.393 1.395 . . . . 0.0 111.008 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -62.58 -36.59 83.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 123.789 0.836 . . . . 0.0 111.566 -174.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -66.35 -20.93 66.22 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.473 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.92 -3.92 59.13 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 122.144 -0.348 . . . . 0.0 111.507 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.5 tp -82.06 -16.23 50.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.201 0.524 . . . . 0.0 110.99 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 31.4 m -57.49 -25.68 60.15 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.068 0.947 . . . . 0.0 112.805 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 16.7 p -70.55 -18.97 62.93 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.763 -0.586 . . . . 0.0 111.795 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 92.9 mt -99.75 10.54 41.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.299 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -47.88 -54.98 10.43 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-O 119.399 -0.667 . . . . 0.0 114.038 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.98 -20.19 59.1 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 122.759 2.306 . . . . 0.0 113.272 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.81 -35.65 43.86 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -69.39 -13.06 62.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.323 0.649 . . . . 0.0 112.379 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -57.57 -30.46 65.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -127.02 97.12 4.83 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 75.1 m -156.46 172.1 19.12 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 123.66 0.784 . . . . 0.0 110.013 179.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 48.8 mtm180 -109.42 142.06 40.94 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -175.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.49 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 71.0 mmm -96.37 142.43 28.5 Favored 'General case' 0 CA--C 1.492 -1.264 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.19 -168.425 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.464 HG11 HG11 ' A' ' 433' ' ' VAL . 4.9 m -131.59 153.56 38.98 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -132.08 127.04 35.24 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -111.47 125.9 54.38 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.347 -177.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -130.04 127.77 40.6 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 172.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . 0.41 ' HB2' HD22 ' A' ' 483' ' ' LEU . 90.5 m-85 -99.22 166.04 11.41 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 8.8 t -84.2 149.09 26.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 177.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -87.06 10.27 17.12 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.992 0.517 . . . . 0.0 111.342 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -63.21 -38.22 90.32 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.899 -179.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -119.37 88.0 2.85 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.984 -0.686 . . . . 0.0 109.631 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.4 mt -67.01 -23.99 65.97 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.329 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -61.11 -51.28 69.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.027 0.205 . . . . 0.0 110.753 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' SER . . . . . 0.406 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 30.2 m -64.06 -36.67 84.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.41 HD22 ' HB2' ' A' ' 475' ' ' PHE . 79.0 mt -69.1 -48.89 61.43 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.66 -45.41 73.85 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.293 1.037 . . . . 0.0 111.101 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.465 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.83 -44.92 66.76 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.57 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -62.66 -43.66 98.24 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -58.38 -42.48 87.16 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.244 0.618 . . . . 0.0 110.513 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -67.72 -44.62 77.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.96 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . 0.465 HG13 ' O ' ' A' ' 485' ' ' GLY . 72.9 mt -64.44 -47.9 87.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 17.5 mmt -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.787 0.327 . . . . 0.0 111.086 -179.276 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.04 -15.09 69.14 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.606 -178.305 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -85.46 2.5 44.34 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.687 0.795 . . . . 0.0 109.712 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.36 30.92 6.36 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 119.452 -1.356 . . . . 0.0 112.774 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -111.63 162.22 15.41 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 122.603 -0.351 . . . . 0.0 110.843 176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -133.73 158.84 42.28 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.48 107.17 1.32 Allowed Glycine 0 N--CA 1.422 -2.245 0 C-N-CA 119.968 -1.111 . . . . 0.0 112.074 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 38.7 t -85.91 121.52 28.66 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 176.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 73.2 t -102.21 120.57 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 122.078 0.942 . . . . 0.0 109.896 -177.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . 0.428 ' NE2' HG23 ' A' ' 534' ' ' VAL . 29.9 m80 -110.09 143.22 40.46 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.591 -178.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . 0.442 ' CE2' ' HA ' ' A' ' 510' ' ' VAL . 1.2 m-85 -99.03 141.73 23.39 Favored Pre-proline 0 C--N 1.266 -3.042 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -177.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -55.7 126.63 23.08 Favored 'Trans proline' 0 C--O 1.247 0.955 0 C-N-CA 121.85 1.7 . . . . 0.0 108.519 171.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . 0.42 ' NE2' ' HA ' ' A' ' 505' ' ' PRO . 10.3 t60 -76.5 116.29 17.05 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.269 0.557 . . . . 0.0 109.52 -173.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 9.9 t -134.9 -46.93 0.73 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.389 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.73 125.36 71.35 Favored Pre-proline 0 N--CA 1.443 -0.795 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 171.494 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . 0.42 ' HA ' ' NE2' ' A' ' 502' ' ' HIS . 42.0 Cg_endo -68.92 -32.74 21.6 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 121.977 1.785 . . . . 0.0 113.975 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 11.1 p -134.43 -13.36 2.33 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -91.95 10.05 30.5 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -175.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.92 143.59 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.123 0 C-N-CA 118.78 -1.168 . . . . 0.0 108.654 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 528' ' ' TYR . 6.6 mpt_? -116.45 174.37 6.1 Favored 'General case' 0 C--N 1.281 -2.413 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.548 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.9 m -126.84 164.09 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 C-N-CA 118.687 -1.205 . . . . 0.0 108.266 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.412 ' HB3' HG12 ' A' ' 526' ' ' ILE . 1.3 pp -137.74 151.02 47.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 117.111 -1.836 . . . . 0.0 111.92 -175.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' MET . . . . . 0.478 ' O ' ' HA2' ' A' ' 524' ' ' GLY . 35.4 tpp -104.77 134.59 47.65 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 58.1 tp -119.39 120.34 36.61 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 123.399 0.68 . . . . 0.0 109.994 -179.446 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 62.5 mt -129.03 146.12 51.08 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.301 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 33.5 t80 -99.09 123.57 43.48 Favored 'General case' 0 C--N 1.282 -2.361 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' SER . . . . . 0.429 ' OG ' ' HD3' ' A' ' 519' ' ' LYS . 38.3 t -99.24 111.16 23.6 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 174.557 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 40.5 m -67.83 -29.25 68.36 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.416 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -75.02 -40.41 60.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.322 0.582 . . . . 0.0 109.694 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . 0.429 ' HD3' ' OG ' ' A' ' 516' ' ' SER . 3.8 mptp? -85.83 -9.91 56.26 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.22 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.4 tptt 63.5 24.28 14.0 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.206 1.402 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.37 167.73 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.961 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 30.9 m-85 -97.09 139.02 33.71 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 56.4 ttp -138.94 148.66 43.83 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.478 ' HA2' ' O ' ' A' ' 512' ' ' MET . . . -160.55 170.82 36.6 Favored Glycine 0 N--CA 1.421 -2.34 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.589 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.466 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.3 mp -115.59 139.98 49.6 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.412 HG12 ' HB3' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -103.59 108.08 58.25 Favored Pre-proline 0 C--N 1.298 -1.667 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.862 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.548 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 37.5 Cg_exo -69.07 133.6 27.26 Favored 'Trans proline' 0 C--O 1.295 3.327 0 C-N-CA 123.852 3.035 . . . . 0.0 114.504 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . 0.571 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 49.4 m-85 -65.68 -45.38 83.08 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 112.541 -2.118 . . . . 0.0 111.776 -176.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -99.51 119.09 37.47 Favored 'General case' 0 CA--C 1.491 -1.327 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.844 -173.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -66.56 -41.86 87.98 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.349 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 44.3 t -65.91 -48.07 72.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -65.57 -43.6 94.25 Favored Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 121.404 -0.427 . . . . 0.0 112.802 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.15 -47.4 57.98 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.436 -177.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . 0.428 HG23 ' NE2' ' A' ' 499' ' ' HIS . 93.7 t -64.62 -38.98 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 110.601 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -61.49 -36.78 81.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.284 0.564 . . . . 0.0 110.172 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.93 -46.4 37.18 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.018 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 31.4 mm -64.25 -28.15 44.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.423 0.689 . . . . 0.0 111.521 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -55.55 -39.37 70.53 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 122.887 0.475 . . . . 0.0 110.626 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -65.35 -40.98 94.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 43.1 t -63.4 -42.63 96.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.553 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.1 -46.31 96.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 38.9 m -61.59 -42.18 98.5 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.71 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -64.39 -43.41 94.52 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.5 tp -56.5 -47.96 78.2 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 110.537 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -62.76 -36.53 83.38 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.239 178.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -72.64 -33.8 66.87 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -58.91 -48.47 81.32 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 58.91 77.07 0.32 Allowed 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 124.673 1.233 . . . . 0.0 109.069 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -73.09 118.19 15.74 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.421 -176.462 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 4.4 p80 63.47 166.07 0.13 Allowed 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.921 2.088 . . . . 0.0 112.733 -177.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--N 1.294 -1.807 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 171.81 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 25.7 ptt? . . . . . 0 CA--C 1.511 -0.54 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 15.8 p -75.7 156.94 34.25 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 13.6 p -79.1 72.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-O 123.054 1.407 . . . . 0.0 111.675 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 19.6 m -98.73 30.63 3.23 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.475 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -97.08 137.1 36.66 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.73 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.24 132.37 54.39 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.313 0.577 . . . . 0.0 110.29 172.727 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . 0.536 HD13 ' CD2' ' A' ' 435' ' ' HIS . 3.0 mp -95.05 132.62 39.74 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.857 -172.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.09 118.83 15.45 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.87 -52.72 2.77 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -172.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.453 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 65.2 t90 -154.57 149.89 27.15 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.266 -171.722 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 22.8 t -131.81 130.05 41.28 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.453 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -162.33 -172.79 30.22 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -177.388 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.496 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.1 t -113.22 139.29 39.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.509 ' O ' ' HA ' ' A' ' 426' ' ' SER . 72.8 mt -113.92 140.96 47.95 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.491 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 58.5 mt-10 -115.37 126.28 54.23 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.833 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 58.6 p-90 -123.03 130.87 53.35 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -173.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -128.49 145.87 50.98 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 114.528 -1.214 . . . . 0.0 111.21 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . 0.498 ' CB ' ' HB2' ' A' ' 452' ' ' LEU . 15.9 tt0 166.74 -69.71 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 127.534 2.333 . . . . 0.0 106.002 171.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -119.27 88.88 38.7 Favored Pre-proline 0 N--CA 1.436 -1.126 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.889 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.42 80.34 3.1 Favored 'Trans proline' 0 N--CA 1.429 -2.272 0 N-CA-C 106.157 -2.286 . . . . 0.0 106.157 168.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -72.69 142.95 84.18 Favored Pre-proline 0 N--CA 1.434 -1.231 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.854 -173.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . 0.52 ' HA ' ' OD2' ' A' ' 418' ' ' ASP . 9.9 Cg_endo -53.01 120.56 7.87 Favored 'Trans proline' 0 C--O 1.255 1.328 0 C-N-CA 122.623 2.215 . . . . 0.0 110.321 173.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -99.8 -34.93 9.96 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.046 0.451 . . . . 0.0 110.574 -177.08 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 61.2 m -156.04 -74.62 0.1 Allowed 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 46.7 t -133.02 85.14 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 121.236 0.541 . . . . 0.0 110.256 -177.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . 0.52 ' OD2' ' HA ' ' A' ' 414' ' ' PRO . 12.5 p-10 -137.91 118.46 13.91 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.864 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.7 -33.83 17.4 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.86 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -81.44 153.24 27.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.476 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 23.7 m -103.82 -30.98 10.03 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.71 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -90.72 89.19 7.4 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 119.082 -1.047 . . . . 0.0 112.075 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.56 143.01 39.84 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.287 175.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 5.6 m -100.58 120.11 39.54 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.29 -1.745 . . . . 0.0 106.29 175.516 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 16.2 mmm180 -103.56 145.11 30.52 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 178.047 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.509 ' HA ' ' O ' ' A' ' 406' ' ' LEU . 33.8 p -141.86 138.44 32.13 Favored 'General case' 0 N--CA 1.414 -2.254 0 O-C-N 123.459 0.475 . . . . 0.0 110.495 -175.263 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 96.8 mt -137.25 118.15 10.78 Favored Pre-proline 0 C--N 1.293 -1.883 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.695 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.27 138.62 56.55 Favored 'Trans proline' 0 C--O 1.249 1.056 0 C-N-CA 122.7 2.267 . . . . 0.0 109.542 170.178 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . 0.496 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 12.5 p -144.98 165.42 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -175.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -116.45 133.25 56.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.9 t -121.45 124.16 71.22 Favored 'Isoleucine or valine' 0 C--O 1.259 1.564 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.459 -174.383 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -105.25 160.81 14.81 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 175.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.478 HG13 HG13 ' A' ' 471' ' ' VAL . 15.5 m -121.97 140.57 45.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 175.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.524 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 27.1 t-20 -96.16 132.18 41.85 Favored 'General case' 1 C--O 1.316 4.565 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.28 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . 0.536 ' CD2' HD13 ' A' ' 399' ' ' LEU . 77.0 m-70 -33.0 160.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 O-C-N 128.305 3.503 . . . . 0.0 116.438 -170.372 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.74 -1.27 30.44 Favored Glycine 0 CA--C 1.497 -1.06 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.48 161.66 13.49 Favored 'General case' 0 C--N 1.289 -2.039 0 C-N-CA 126.194 1.798 . . . . 0.0 115.121 -172.313 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -159.36 98.88 1.44 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 168.418 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -139.19 139.38 37.5 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.732 -0.605 . . . . 0.0 112.163 -175.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -103.07 106.6 17.15 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 25.2 p -80.28 -2.79 46.67 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 122.215 1.007 . . . . 0.0 112.435 -175.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.13 -14.22 60.94 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.225 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -101.45 9.61 41.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.782 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 33.7 m0 -99.08 140.64 21.85 Favored Pre-proline 0 C--O 1.247 0.945 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.368 176.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.64 153.99 64.54 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.877 1.718 . . . . 0.0 109.816 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -81.0 -5.16 57.25 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 92.3 mttt -132.21 126.21 33.0 Favored 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.341 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 73.5 mt -118.6 146.99 44.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 63.4 mt -105.02 125.97 59.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.501 -177.433 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 48.5 ttp -106.79 118.02 35.58 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.426 179.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -99.86 127.04 46.06 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 175.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . 0.498 ' HB2' ' CB ' ' A' ' 410' ' ' GLU . 29.6 mt -86.67 136.79 32.9 Favored 'General case' 0 C--N 1.28 -2.413 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.31 161.27 60.14 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.83 129.09 16.92 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.348 1.366 . . . . 0.0 111.234 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.37 -25.13 68.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.916 0.886 . . . . 0.0 111.77 -177.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -58.76 -37.04 75.37 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 120.851 0.358 . . . . 0.0 110.976 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 7.7 mp -83.3 3.21 32.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.298 0.57 . . . . 0.0 111.42 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.95 -16.45 61.53 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.882 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 18.8 p -58.74 -30.62 67.62 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.854 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 7.5 m -71.27 -18.81 62.41 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.538 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.02 5.28 38.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 122.106 -0.371 . . . . 0.0 111.806 -175.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.3 -55.44 3.04 Favored Glycine 0 CA--C 1.559 2.781 0 CA-C-N 114.854 -1.067 . . . . 0.0 115.304 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.23 -26.43 76.5 Favored 'Trans proline' 0 C--N 1.368 1.588 0 C-N-CA 123.405 2.737 . . . . 0.0 114.011 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.77 -46.12 66.51 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -72.64 -14.72 61.66 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.215 -178.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -70.47 -24.77 62.92 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.357 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -122.2 85.04 2.35 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' SER . . . . . 0.418 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 53.2 m -151.73 163.04 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.639 0.733 . . . . 0.0 112.657 -175.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.37 142.91 41.4 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 126.28 1.832 . . . . 0.0 106.458 177.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.524 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 1.9 mmm -96.66 151.33 19.73 Favored 'General case' 0 CA--C 1.487 -1.447 0 C-N-CA 118.439 -1.305 . . . . 0.0 110.976 -168.207 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.478 HG13 HG13 ' A' ' 433' ' ' VAL . 35.9 m -135.21 154.34 35.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 C-N-CA 123.695 0.798 . . . . 0.0 109.239 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -134.14 123.64 24.74 Favored 'General case' 0 C--N 1.285 -2.215 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.444 ' CE2' HD13 ' A' ' 406' ' ' LEU . 25.6 m-85 -107.91 133.4 52.3 Favored 'General case' 0 C--O 1.278 2.564 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.901 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -131.03 123.63 29.13 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 172.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . 0.496 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 98.4 m-85 -93.25 166.01 12.52 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 123.091 0.244 . . . . 0.0 110.545 -177.196 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 9.9 t -81.84 137.56 35.24 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.25 37.17 0.76 Allowed 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.092 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -78.95 -52.93 7.59 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.096 0.474 . . . . 0.0 111.001 177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -103.9 78.22 1.52 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.987 0.899 . . . . 0.0 108.65 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.84 -22.32 66.58 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.321 -1.309 . . . . 0.0 113.478 -175.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -69.52 -36.94 76.88 Favored 'General case' 0 C--N 1.31 -1.138 0 O-C-N 122.963 0.164 . . . . 0.0 111.248 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 66.6 m -67.42 -40.04 85.52 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.632 174.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.414 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 3.7 mm? -63.76 -45.93 87.59 Favored 'General case' 0 C--O 1.206 -1.214 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.739 176.62 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -55.21 -45.68 75.91 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.811 0.444 . . . . 0.0 110.611 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.421 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.44 -44.23 74.38 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.033 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 1.1 tt -63.72 -43.81 95.45 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.438 0.695 . . . . 0.0 109.883 -177.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . 0.414 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 10.3 m-85 -56.91 -42.52 80.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.961 0.504 . . . . 0.0 111.053 177.281 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 492' ' ' ASN . 55.5 mtp180 -67.26 -44.57 79.05 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.816 178.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . 0.473 HG22 HD11 ' A' ' 452' ' ' LEU . 75.4 mt -61.04 -48.18 90.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 O-C-N 123.396 0.435 . . . . 0.0 110.688 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 20.7 mmt -63.64 -46.63 84.78 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -68.5 -20.61 73.87 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.408 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . 0.436 ' HB2' ' O ' ' A' ' 488' ' ' ARG . 4.0 t30 -80.78 0.24 35.65 Favored 'General case' 0 C--O 1.245 0.866 0 CA-C-O 121.551 0.691 . . . . 0.0 110.197 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.99 31.09 6.4 Favored Glycine 0 N--CA 1.439 -1.128 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.384 177.592 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -109.88 162.22 14.7 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 122.36 -0.494 . . . . 0.0 110.396 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -135.93 150.17 49.2 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -111.63 111.72 2.97 Favored Glycine 0 N--CA 1.43 -1.731 0 C-N-CA 119.482 -1.342 . . . . 0.0 113.031 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.06 115.55 22.94 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 176.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 47.6 t -101.48 120.85 51.65 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 CA-C-O 121.575 0.702 . . . . 0.0 109.535 -175.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -111.5 139.82 46.61 Favored 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.086 -1.416 . . . . 0.0 110.508 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -102.21 133.43 20.62 Favored Pre-proline 0 C--N 1.292 -1.894 0 CA-C-N 113.915 -1.493 . . . . 0.0 108.761 -178.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -57.92 141.75 96.16 Favored 'Trans proline' 0 C--O 1.255 1.345 0 N-CA-C 107.815 -1.648 . . . . 0.0 107.815 167.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -75.38 116.44 16.11 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.934 0.873 . . . . 0.0 110.632 -171.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 19.0 m -130.08 -42.86 1.21 Allowed 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.482 -177.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -85.11 118.9 71.81 Favored Pre-proline 0 C--O 1.24 0.587 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.72 175.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . 0.425 ' C ' ' H ' ' A' ' 507' ' ' GLU . 25.9 Cg_exo -68.62 -28.92 30.78 Favored 'Trans proline' 0 N--CA 1.48 0.683 0 C-N-CA 122.93 2.42 . . . . 0.0 111.217 177.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 48.6 t -83.32 36.36 0.52 Allowed 'General case' 0 C--O 1.25 1.099 0 C-N-CA 123.605 0.762 . . . . 0.0 109.311 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . 0.425 ' H ' ' C ' ' A' ' 505' ' ' PRO . 36.7 mt-10 67.58 110.9 0.04 OUTLIER 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 111.841 -178.701 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 13.9 p -70.62 -27.48 31.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.255 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 31.8 mtt180 73.42 169.07 0.31 Allowed 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.249 1.42 . . . . 0.0 109.614 175.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.537 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 16.0 m -131.1 163.91 35.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.903 -174.411 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.478 ' CB ' HG12 ' A' ' 526' ' ' ILE . 3.3 pp -138.33 154.96 48.98 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 118.068 -1.453 . . . . 0.0 110.541 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 41.3 ttm -117.25 130.1 56.34 Favored 'General case' 0 C--N 1.295 -1.772 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.534 173.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . 0.444 HD12 ' HB3' ' A' ' 522' ' ' PHE . 34.9 tp -95.63 129.78 42.72 Favored 'General case' 0 N--CA 1.411 -2.404 0 O-C-N 124.018 0.824 . . . . 0.0 108.991 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 64.4 mt -133.02 148.84 52.23 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.326 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -100.05 121.9 42.09 Favored 'General case' 0 C--N 1.271 -2.822 0 O-C-N 122.233 -0.292 . . . . 0.0 110.477 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 37.9 t -95.23 109.43 21.54 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.0 m -68.81 -35.41 76.96 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.733 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -69.6 -31.34 69.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.276 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -97.59 -9.99 25.97 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.842 0.353 . . . . 0.0 110.4 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 59.57 35.89 22.68 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 124.35 1.06 . . . . 0.0 111.413 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -143.01 167.5 14.07 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . 0.444 ' HB3' HD12 ' A' ' 513' ' ' LEU . 52.5 m-85 -98.83 138.57 35.78 Favored 'General case' 0 N--CA 1.413 -2.305 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.901 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.4 ptm -127.06 165.88 18.65 Favored 'General case' 0 C--N 1.284 -2.274 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.419 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -170.19 150.88 15.34 Favored Glycine 0 N--CA 1.41 -3.047 0 C-N-CA 119.054 -1.546 . . . . 0.0 112.055 177.276 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.463 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.8 mp -114.29 140.24 48.76 Favored 'General case' 0 C--N 1.273 -2.743 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.478 HG12 ' CB ' ' A' ' 511' ' ' LEU . 7.3 mt -99.24 108.05 47.89 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 123.793 0.683 . . . . 0.0 110.812 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.537 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 34.2 Cg_exo -68.69 131.2 22.23 Favored 'Trans proline' 0 C--O 1.295 3.348 0 C-N-CA 122.102 1.868 . . . . 0.0 110.963 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -74.63 -41.57 60.14 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.389 -1.732 . . . . 0.0 110.27 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -73.85 84.89 1.7 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.995 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -66.37 -43.79 84.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.127 -179.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 15.2 m -61.34 -44.0 97.92 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.31 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -68.56 -44.86 70.09 Favored Glycine 0 C--O 1.243 0.713 0 C-N-CA 121.171 -0.537 . . . . 0.0 112.866 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.482 ' CE2' HG13 ' A' ' 537' ' ' ILE . 67.6 t80 -67.4 -48.27 67.85 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 122.126 0.17 . . . . 0.0 111.117 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.2 -37.94 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 O-C-N 123.187 0.304 . . . . 0.0 110.567 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -58.2 -46.91 84.99 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.039 0.447 . . . . 0.0 110.383 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.95 -43.38 49.65 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.706 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.538 ' O ' HG12 ' A' ' 541' ' ' ILE . 32.8 mm -62.03 -36.24 73.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 122.383 0.273 . . . . 0.0 111.56 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -60.65 -35.4 76.1 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.202 0.525 . . . . 0.0 110.672 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.07 -37.71 75.55 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.31 -37.94 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.642 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.538 HG12 ' O ' ' A' ' 537' ' ' ILE . 43.8 mm -60.39 -45.68 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 92.4 m -59.68 -42.93 94.03 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.658 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -67.43 -37.29 82.81 Favored 'General case' 0 C--O 1.203 -1.39 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.558 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . 0.402 ' HB3' ' O ' ' A' ' 541' ' ' ILE . 51.9 tp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 124.197 0.999 . . . . 0.0 111.372 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . 0.522 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 46.7 mt-10 -65.39 -38.81 91.1 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.99 -178.801 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -83.09 -40.95 19.17 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.251 -177.138 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -117.86 105.17 11.66 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.0 0.429 . . . . 0.0 111.354 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -95.29 44.47 1.09 Allowed 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -121.61 132.2 54.54 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -123.17 11.01 9.41 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 170.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 N--CA 1.424 -1.773 0 CA-C-N 112.46 -2.154 . . . . 0.0 105.591 -179.952 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 90.2 mtp . . . . . 0 CA--C 1.495 -1.137 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 17.0 t 63.48 41.12 7.71 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 124.032 0.833 . . . . 0.0 110.321 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.75 -14.4 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.135 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 15.0 m -86.59 -29.28 22.72 Favored 'General case' 0 N--CA 1.441 -0.913 0 O-C-N 121.506 -0.746 . . . . 0.0 109.644 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -76.8 -44.18 33.66 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.222 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.432 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -149.96 135.18 18.05 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.507 0.67 . . . . 0.0 112.375 -179.338 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . 0.472 HD13 ' ND1' ' A' ' 435' ' ' HIS . 3.2 mp -115.25 137.47 52.0 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 171.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.46 121.7 17.51 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.39 -57.08 2.13 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.443 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 61.2 t90 -153.37 145.36 23.66 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 120.895 0.379 . . . . 0.0 111.188 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 25.0 p -119.72 126.91 52.22 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.313 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.443 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -165.47 -172.23 32.64 Favored Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.328 -176.351 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.486 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 59.5 t -113.19 135.54 52.37 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -177.474 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.417 ' CD1' ' HB2' ' A' ' 448' ' ' LEU . 15.7 tp -113.94 136.81 52.48 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.436 ' HG2' ' CB ' ' A' ' 426' ' ' SER . 51.6 mt-10 -114.54 133.87 55.46 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -178.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 51.1 p-90 -127.39 142.08 51.52 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . 0.485 ' HB2' ' OE1' ' A' ' 451' ' ' GLN . 21.2 mt-30 -140.05 152.67 46.39 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.188 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.9 -56.71 2.42 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.522 174.774 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . 0.41 ' HB3' ' HZ1' ' A' ' 411' ' ' LYS . 9.3 mtpm? 42.68 83.73 0.2 Allowed Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 176.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.7 -39.73 8.39 Favored 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 121.574 1.516 . . . . 0.0 110.456 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -104.01 139.92 20.57 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.78 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -43.86 -59.46 1.06 Allowed 'Trans proline' 0 C--N 1.361 1.233 0 C-N-CA 124.624 3.549 . . . . 0.0 114.582 -175.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -101.27 -25.6 13.93 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.058 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.6 m 68.05 -82.14 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.469 1.108 . . . . 0.0 108.752 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 96.4 t -145.56 -68.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.759 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -136.55 137.81 40.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.419 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.08 78.02 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -176.444 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -83.13 -15.4 50.86 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.225 0.535 . . . . 0.0 110.562 -174.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 26.9 m -75.03 -26.17 59.27 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.918 0.866 . . . . 0.0 109.818 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 46.7 mttm -98.71 91.78 5.27 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.177 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 92.0 mt -73.07 116.8 14.03 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.843 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' THR . . . . . 0.402 ' CG2' ' HB3' ' A' ' 407' ' ' GLU . 19.9 m -63.49 137.63 58.21 Favored 'General case' 0 N--CA 1.409 -2.496 0 CA-C-N 114.448 -1.251 . . . . 0.0 108.514 177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 42.4 mmt180 -90.1 144.15 26.14 Favored 'General case' 0 N--CA 1.411 -2.405 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.436 ' CB ' ' HG2' ' A' ' 407' ' ' GLU . 1.0 OUTLIER -137.85 130.14 29.17 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -177.315 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 90.3 mt -131.47 126.73 21.34 Favored Pre-proline 0 C--N 1.294 -1.809 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -60.23 138.71 83.06 Favored 'Trans proline' 0 C--O 1.249 1.03 0 C-N-CA 122.286 1.991 . . . . 0.0 110.742 172.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.6 p -145.95 157.4 43.89 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.038 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -117.36 129.37 55.83 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 46.5 t -113.67 124.2 70.08 Favored 'Isoleucine or valine' 0 C--O 1.257 1.469 0 CA-C-O 121.732 0.777 . . . . 0.0 111.129 -173.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.54 161.34 15.15 Favored 'General case' 0 C--N 1.28 -2.415 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.321 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 6.1 m -119.79 140.71 42.92 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 174.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.509 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 26.8 t-20 -94.06 130.13 40.32 Favored 'General case' 1 C--O 1.339 5.809 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 171.713 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . 0.472 ' ND1' HD13 ' A' ' 399' ' ' LEU . 0.5 OUTLIER -47.53 165.05 0.03 OUTLIER 'General case' 0 C--N 1.357 0.893 0 O-C-N 128.931 3.894 . . . . 0.0 115.372 -162.385 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . 0.434 ' H ' ' CD2' ' A' ' 435' ' ' HIS . . . 110.14 -2.98 29.88 Favored Glycine 0 N--CA 1.423 -2.168 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -172.146 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.442 ' OE1' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -132.38 159.59 38.79 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.558 -174.403 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -152.57 98.67 2.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 170.728 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . 0.534 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -118.82 158.53 25.45 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.947 0.403 . . . . 0.0 111.91 -177.846 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -102.14 118.13 36.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 20.2 p -95.97 8.0 44.85 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.346 1.069 . . . . 0.0 109.626 179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.81 -22.84 66.59 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.205 -1.362 . . . . 0.0 111.412 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -107.47 17.27 22.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.036 0.446 . . . . 0.0 111.532 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -91.17 136.03 27.7 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.433 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -64.43 158.75 47.65 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.156 1.904 . . . . 0.0 109.469 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.02 -7.09 59.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.123 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.486 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 88.8 mttt -128.5 130.38 47.41 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 122.756 0.422 . . . . 0.0 110.59 176.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . 0.417 ' HB2' ' CD1' ' A' ' 406' ' ' LEU . 83.8 mt -119.16 147.27 44.38 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 43.9 mm -99.22 120.54 48.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.459 ' SD ' HD21 ' A' ' 513' ' ' LEU . 56.2 ttp -111.96 119.28 37.96 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.067 0.46 . . . . 0.0 111.333 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . 0.485 ' OE1' ' HB2' ' A' ' 409' ' ' GLN . 14.7 mm100 -104.9 133.16 50.17 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 176.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.02 122.09 29.56 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 120.969 0.414 . . . . 0.0 111.0 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 pt -129.77 157.81 75.58 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.676 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.41 129.34 29.3 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 121.832 1.688 . . . . 0.0 113.134 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.74 -25.46 68.21 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.197 0.999 . . . . 0.0 111.57 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -57.62 -41.49 81.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.584 0.753 . . . . 0.0 111.742 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.04 5.58 21.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.133 -172.259 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.97 -27.21 36.09 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.599 -178.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -31.43 67.08 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -174.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.7 m -72.46 -17.85 61.73 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.364 0.666 . . . . 0.0 112.439 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 10.8 tp -85.6 11.12 11.41 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.304 0.642 . . . . 0.0 111.318 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -37.6 -54.54 1.77 Allowed Glycine 0 CA--C 1.545 1.966 0 N-CA-C 116.667 1.427 . . . . 0.0 116.667 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.21 -40.67 51.54 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 123.07 2.513 . . . . 0.0 113.424 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.76 -30.45 70.67 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.201 0.524 . . . . 0.0 111.355 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -78.07 -13.11 59.99 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.444 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -74.78 -43.33 55.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.621 175.81 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 9.8 p-10 -95.54 74.2 3.24 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 122.025 0.917 . . . . 0.0 110.057 177.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -142.32 169.85 16.81 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.95 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.534 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 14.3 ptp180 -139.63 143.79 37.37 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 127.529 2.332 . . . . 0.0 105.724 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.509 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 62.1 mtp -97.23 153.12 18.22 Favored 'General case' 0 CA--C 1.483 -1.599 0 C-N-CA 115.982 -2.287 . . . . 0.0 111.875 -167.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.517 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 34.8 m -133.03 159.76 42.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.993 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.28 121.39 21.21 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 14.1 m-85 -107.3 117.65 34.65 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.198 -177.27 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -111.87 122.27 47.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -93.81 160.57 14.69 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.532 -176.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' THR . . . . . 0.462 ' O ' HD12 ' A' ' 483' ' ' LEU . 10.1 t -66.35 138.29 57.5 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 123.73 0.644 . . . . 0.0 109.532 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -98.6 26.86 5.22 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -60.25 -52.03 67.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.188 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -128.23 104.18 7.6 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.548 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.96 -23.0 65.91 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.346 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -69.91 -41.5 74.58 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 120.809 0.337 . . . . 0.0 111.211 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 35.7 m -63.67 -35.31 80.12 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.749 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.462 HD12 ' O ' ' A' ' 476' ' ' THR . 93.5 mt -73.03 -51.41 18.26 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.04 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -55.33 -36.77 66.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.193 0.597 . . . . 0.0 111.628 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.495 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -60.51 -50.83 63.26 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.02 -42.8 89.15 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 123.251 0.62 . . . . 0.0 110.772 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -58.26 -45.51 87.69 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.18 0.592 . . . . 0.0 110.295 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -65.41 -38.57 90.35 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.391 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . 0.495 HG13 ' O ' ' A' ' 485' ' ' GLY . 80.4 mt -68.21 -50.38 58.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.988 0.423 . . . . 0.0 110.572 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' MET . . . . . 0.487 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 91.8 mtp -70.72 -35.79 72.89 Favored 'General case' 0 C--N 1.312 -1.039 0 O-C-N 122.134 -0.354 . . . . 0.0 111.592 -176.325 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.76 -18.66 70.56 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -81.92 6.84 14.61 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.869 0.842 . . . . 0.0 110.107 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.35 29.73 6.94 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.529 -0.843 . . . . 0.0 113.015 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -112.45 158.67 19.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -129.28 160.14 33.92 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -115.1 115.81 3.55 Favored Glycine 0 N--CA 1.417 -2.599 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . 0.413 ' SG ' HG22 ' A' ' 537' ' ' ILE . 42.6 t -92.74 118.89 31.55 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . 0.403 HG21 ' HB2' ' A' ' 450' ' ' MET . 78.0 t -101.66 120.78 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 CA-C-O 121.361 0.6 . . . . 0.0 110.151 -178.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . 0.494 ' NE2' HG21 ' A' ' 534' ' ' VAL . 27.1 m80 -109.36 140.46 43.02 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.41 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . 0.415 ' CE2' ' HA ' ' A' ' 510' ' ' VAL . 4.2 m-85 -104.06 125.89 33.21 Favored Pre-proline 0 C--N 1.292 -1.934 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.535 -175.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.29 107.06 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 121.902 1.735 . . . . 0.0 108.351 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -91.23 117.47 29.66 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -172.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 13.1 p -76.43 -58.68 3.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.432 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.28 122.83 75.55 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.236 173.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -81.11 2.24 8.72 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.34 2.027 . . . . 0.0 112.412 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.3 -69.66 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.241 0.616 . . . . 0.0 110.1 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -169.91 108.35 0.38 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.571 0.7 . . . . 0.0 111.474 174.356 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 32.3 t -100.95 -16.82 7.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 169.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 20.4 mtm-85 72.82 177.08 0.26 Allowed 'General case' 0 C--N 1.371 1.51 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.274 177.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.483 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 5.6 m -133.83 162.33 39.58 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.664 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.541 ' HB2' HG12 ' A' ' 526' ' ' ILE . 0.9 OUTLIER -134.19 136.52 43.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.08 0.854 . . . . 0.0 113.172 -171.429 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' MET . . . . . 0.451 ' N ' HD21 ' A' ' 511' ' ' LEU . 49.1 tpp -101.83 118.83 37.74 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.239 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . 0.459 HD21 ' SD ' ' A' ' 450' ' ' MET . 24.2 tp -105.14 126.62 52.28 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.531 0.681 . . . . 0.0 110.183 -177.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 79.6 mt -123.97 135.04 53.38 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.184 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -89.61 123.44 33.68 Favored 'General case' 0 C--N 1.285 -2.212 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.335 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.3 t -98.72 110.19 22.83 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 31.7 m -68.33 -27.25 66.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.494 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.17 -44.13 96.29 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.422 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -103.79 1.09 31.2 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.821 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . 0.421 0.0 OUTLIER 49.15 34.92 6.44 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.11 2.164 . . . . 0.0 114.421 -176.352 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -137.62 167.83 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.802 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.095 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . 0.487 ' HE1' ' SD ' ' A' ' 490' ' ' MET . 70.0 m-85 -98.19 136.79 37.9 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.233 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -119.56 145.91 45.96 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -156.23 154.12 25.27 Favored Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 118.285 -1.912 . . . . 0.0 113.516 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.501 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 10.6 mp -115.37 135.02 54.56 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 171.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.541 HG12 ' HB2' ' A' ' 511' ' ' LEU . 16.5 mt -101.36 107.45 50.84 Favored Pre-proline 0 N--CA 1.439 -0.983 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.566 ' HG2' ' CD2' ' A' ' 533' ' ' PHE . 35.9 Cg_exo -72.19 138.46 30.62 Favored 'Trans proline' 0 C--O 1.292 3.179 0 C-N-CA 122.994 2.463 . . . . 0.0 111.944 170.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -77.07 -43.07 35.74 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.302 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.41 92.25 4.57 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.64 0.734 . . . . 0.0 110.156 -176.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . 0.253 0.0 OUTLIER -67.21 -31.08 71.21 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 114.959 -1.018 . . . . 0.0 113.569 -179.367 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.3 m -62.83 -47.55 82.9 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -176.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.98 -34.69 52.07 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.229 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.566 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 49.9 t80 -68.36 -48.08 65.73 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . 0.494 HG21 ' NE2' ' A' ' 499' ' ' HIS . 95.2 t -64.44 -39.12 84.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 O-C-N 123.181 0.3 . . . . 0.0 110.508 -178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -67.12 -40.38 86.8 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 109.762 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -64.09 -46.53 90.96 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.54 ' O ' HG13 ' A' ' 541' ' ' ILE . 43.7 mm -64.01 -37.38 79.65 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 C-N-CA 122.247 0.219 . . . . 0.0 110.799 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -57.87 -39.67 78.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 110.119 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . 0.404 ' HA ' HG21 ' A' ' 542' ' ' THR . 49.0 mt-30 -67.66 -34.09 76.23 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 91.1 t -67.41 -48.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.748 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.54 HG13 ' O ' ' A' ' 537' ' ' ILE . 62.2 mt -60.97 -44.88 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' THR . . . . . 0.495 ' HA ' ' OE2' ' A' ' 545' ' ' GLU . 1.9 t -67.86 -33.55 74.97 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.822 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.25 -42.55 88.42 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.79 -32.93 69.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.577 0.751 . . . . 0.0 110.664 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . 0.495 ' OE2' ' HA ' ' A' ' 542' ' ' THR . 44.3 mt-10 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.865 0.364 . . . . 0.0 111.099 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 17.8 m-70 -97.76 -16.07 20.03 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.362 0.601 . . . . 0.0 110.613 -177.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -72.67 135.05 45.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.033 -175.028 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -82.08 92.95 6.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-O 121.309 0.576 . . . . 0.0 109.491 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -83.48 174.02 10.97 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.335 177.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -69.29 96.9 0.89 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.524 0.678 . . . . 0.0 109.6 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.4 t60 . . . . . 0 C--N 1.287 -2.137 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 -178.891 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 68.2 mtm . . . . . 0 CA--C 1.503 -0.831 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 23.0 t -108.73 145.54 34.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 178.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 61.8 t -80.79 131.05 34.85 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 27.7 m -71.51 123.45 22.45 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -72.37 -26.16 61.79 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.82 144.02 18.81 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 114.215 -1.357 . . . . 0.0 107.759 175.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . 0.473 HD13 ' CD2' ' A' ' 435' ' ' HIS . 3.2 mp -108.68 136.29 48.51 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 64.1 tp -70.1 118.83 13.43 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.19 -51.24 2.86 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.491 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 78.4 t90 -155.19 149.21 25.72 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.459 -172.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 13.1 p -130.61 117.63 19.81 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 176.695 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.491 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -159.54 -172.53 26.83 Favored Glycine 0 N--CA 1.433 -1.562 0 C-N-CA 119.795 -1.193 . . . . 0.0 112.589 -175.794 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -112.03 136.69 47.43 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-O 121.099 0.476 . . . . 0.0 109.876 -176.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.519 HD12 ' SG ' ' A' ' 429' ' ' CYS . 10.4 mp -113.19 139.08 49.07 Favored 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.481 ' HG3' ' HB3' ' A' ' 426' ' ' SER . 30.2 tt0 -116.22 126.83 54.16 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -178.411 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . 0.409 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 19.3 p-90 -107.15 131.86 53.66 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.46 0.647 . . . . 0.0 112.584 -175.868 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -106.67 138.82 42.13 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.227 -177.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -44.34 -60.52 1.89 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.934 1.294 . . . . 0.0 111.425 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -156.72 147.28 16.12 Favored Pre-proline 0 N--CA 1.426 -1.668 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 -178.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -50.43 113.91 1.23 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.726 2.284 . . . . 0.0 111.753 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 64.6 mttp 71.09 80.27 0.19 Allowed Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 124.633 1.173 . . . . 0.0 112.993 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -105.4 39.07 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.737 2.958 . . . . 0.0 109.706 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -82.6 -34.12 27.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.17 -174.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 5.6 p -94.6 -53.09 4.02 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.823 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.29 120.54 63.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -115.36 148.18 39.61 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -86.61 -39.89 15.69 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -160.99 88.43 0.76 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.388 1.075 . . . . 0.0 110.591 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 2.9 p -79.16 -96.05 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.033 173.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt 62.67 -68.0 0.08 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.679 1.592 . . . . 0.0 111.185 -178.4 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 52.7 tp -146.44 132.17 18.95 Favored 'General case' 0 C--N 1.277 -2.565 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 -178.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 1.5 m -76.35 146.83 38.53 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.23 144.29 33.13 Favored 'General case' 0 N--CA 1.416 -2.164 0 C-N-CA 117.159 -1.816 . . . . 0.0 111.321 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.481 ' HB3' ' HG3' ' A' ' 407' ' ' GLU . 51.4 p -142.2 138.55 31.57 Favored 'General case' 0 N--CA 1.409 -2.506 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 81.1 mt -135.41 135.77 23.0 Favored Pre-proline 0 C--N 1.307 -1.242 0 O-C-N 122.852 0.095 . . . . 0.0 110.861 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.45 135.93 20.9 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.573 2.182 . . . . 0.0 112.043 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . 0.519 ' SG ' HD12 ' A' ' 406' ' ' LEU . 20.3 p -142.29 167.13 22.84 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.493 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -115.79 129.88 56.62 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 45.3 t -114.05 123.98 70.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.719 0 CA-C-O 122.143 0.973 . . . . 0.0 110.792 -175.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -113.47 160.42 18.48 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 114.035 -1.439 . . . . 0.0 107.39 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.493 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 15.4 m -122.75 141.77 41.87 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 CA-C-O 120.694 0.283 . . . . 0.0 111.6 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 470' ' ' MET . 3.0 m120 -94.59 132.16 39.59 Favored 'General case' 1 C--O 1.314 4.448 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 168.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . 0.473 ' CD2' HD13 ' A' ' 399' ' ' LEU . 73.4 m-70 -39.26 165.72 0.0 OUTLIER 'General case' 0 C--N 1.37 1.463 0 O-C-N 127.387 2.929 . . . . 0.0 116.197 -168.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.33 -2.39 31.1 Favored Glycine 0 CA--C 1.502 -0.766 0 N-CA-C 109.096 -1.601 . . . . 0.0 109.096 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.404 ' CB ' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -106.63 161.91 14.22 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.05 -1.075 . . . . 0.0 113.118 -174.439 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -160.88 94.49 1.03 Allowed 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . 0.501 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 2.3 pt? -141.92 151.22 42.41 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.252 178.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -102.47 135.49 44.0 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 14.0 p -94.6 23.15 5.54 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -171.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -75.55 -28.33 58.97 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.255 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -72.07 -15.52 62.01 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.208 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -88.24 126.84 59.32 Favored Pre-proline 0 C--N 1.311 -1.07 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.455 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . 0.404 ' HG2' ' HD2' ' A' ' 501' ' ' PRO . 23.5 Cg_exo -69.84 157.88 58.73 Favored 'Trans proline' 0 C--O 1.224 -0.223 0 C-N-CA 122.186 1.924 . . . . 0.0 110.05 173.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -77.35 -5.98 51.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.128 0.489 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -119.9 124.94 47.27 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 53.2 mt -118.17 146.69 44.01 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.105 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 71.8 mt -101.93 117.79 47.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.887 -176.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.416 ' HA ' ' O ' ' A' ' 497' ' ' CYS . 23.3 ptm -112.82 128.96 56.58 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 121.586 0.708 . . . . 0.0 110.067 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -114.76 130.75 56.89 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.99 124.63 29.31 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.498 0.666 . . . . 0.0 111.503 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.6 pt -133.82 161.42 63.84 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.395 1.078 . . . . 0.0 108.814 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -65.64 128.98 21.18 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 121.385 1.39 . . . . 0.0 111.406 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -63.86 -26.61 68.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.586 0.754 . . . . 0.0 110.388 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.27 -33.02 67.19 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.335 1.054 . . . . 0.0 112.7 -174.067 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -87.06 8.79 22.03 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -177.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 39.0 tp -69.73 -22.68 63.36 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.303 0.573 . . . . 0.0 110.483 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 5.1 m -65.62 -29.52 70.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.671 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 9.9 m -72.04 -20.39 61.69 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.757 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 83.1 mt -96.03 10.33 37.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.599 -175.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.22 -51.5 8.99 Favored Glycine 0 CA--C 1.553 2.462 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.1 -19.5 66.6 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.893 2.395 . . . . 0.0 113.94 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -80.16 -42.36 23.57 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -71.68 -13.66 61.8 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.583 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -53.86 -31.79 50.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.14 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -138.13 97.84 3.49 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.9 m -150.4 170.21 19.59 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.292 0.568 . . . . 0.0 111.553 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . 0.501 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 97.3 mtt180 -112.52 142.51 45.0 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.478 ' HB2' ' HB2' ' A' ' 434' ' ' ASN . 61.5 mtp -98.78 151.96 20.22 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 116.944 -1.903 . . . . 0.0 111.242 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.501 HG21 ' O ' ' A' ' 524' ' ' GLY . 26.4 m -135.09 155.39 37.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.891 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -127.76 129.76 47.59 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.465 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 25.0 m-85 -112.88 117.98 33.63 Favored 'General case' 0 C--N 1.282 -2.326 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.847 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -121.31 123.73 42.88 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -81.02 153.14 27.58 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.624 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 18.8 p -71.58 -9.96 59.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -173.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 63.17 28.02 15.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.481 0.713 . . . . 0.0 111.231 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.503 ' HE2' ' HA ' ' A' ' 478' ' ' LYS . 10.7 mmpt? -64.82 -46.08 83.47 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.272 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -130.47 102.38 6.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 80.7 mt -66.19 -33.74 76.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.261 -174.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -70.5 -36.55 73.86 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.944 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 38.7 m -65.09 -38.0 89.34 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.13 -41.86 89.91 Favored 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.007 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -54.41 -41.26 69.11 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.037 0.535 . . . . 0.0 111.6 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.482 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -63.15 -46.51 93.05 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.708 178.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.0 tp -66.7 -41.59 87.77 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.73 0.412 . . . . 0.0 110.737 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -61.16 -38.89 88.09 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.237 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -66.39 -46.0 78.13 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . 0.482 HG13 ' O ' ' A' ' 485' ' ' GLY . 67.6 mt -62.55 -51.15 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' MET . . . . . 0.488 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 85.3 mtp -73.46 -36.19 65.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.117 0.484 . . . . 0.0 111.558 -176.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.34 71.03 Favored Glycine 0 C--O 1.219 -0.804 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.602 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.5 4.97 25.62 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.036 0.934 . . . . 0.0 110.611 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.57 29.52 6.96 Favored Glycine 0 C--N 1.316 -0.581 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.042 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -112.61 147.38 36.82 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 174.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -118.61 159.98 22.62 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.05 115.87 3.19 Favored Glycine 0 N--CA 1.421 -2.327 0 C-N-CA 120.189 -1.005 . . . . 0.0 110.721 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . 0.416 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.1 t -88.32 128.3 35.49 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 75.6 t -100.99 120.57 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-O 121.664 0.745 . . . . 0.0 109.3 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -113.42 134.66 54.53 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . 0.469 ' C ' ' H ' ' A' ' 502' ' ' HIS . 92.1 m-85 -84.12 132.24 48.58 Favored Pre-proline 0 C--N 1.289 -2.061 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.035 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . 0.404 ' HD2' ' HG2' ' A' ' 445' ' ' PRO . 31.4 Cg_exo -62.71 3.4 0.51 Allowed 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.595 2.863 . . . . 0.0 114.72 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . 0.469 ' H ' ' C ' ' A' ' 500' ' ' PHE . 49.1 m170 -103.2 115.76 31.19 Favored 'General case' 0 C--N 1.271 -2.835 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 172.939 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 15.6 p -110.41 35.21 3.53 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.571 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -71.54 126.5 91.65 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.264 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.02 -6.51 13.03 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.301 2.667 . . . . 0.0 112.042 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 56.1 m -74.53 0.08 15.96 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.439 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 80.73 93.93 0.05 OUTLIER 'General case' 0 C--O 1.244 0.785 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 170.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.03 -16.14 8.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 172.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 75.14 -178.67 0.16 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.395 1.478 . . . . 0.0 109.754 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.551 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.7 m -138.14 162.83 30.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.854 -0.739 . . . . 0.0 109.855 176.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 17.7 tp -135.01 150.04 50.26 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -170.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 40.2 tpp -108.93 140.78 41.95 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 52.7 tp -125.57 122.89 37.81 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.244 0.545 . . . . 0.0 109.952 179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 73.3 mt -126.98 139.31 53.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.114 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -93.83 124.55 37.9 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.559 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 16.9 m -106.7 110.58 22.8 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 176.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 18.5 m -68.57 -35.68 77.71 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.834 -1.075 . . . . 0.0 113.218 -174.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -77.3 -29.41 53.69 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 121.449 0.643 . . . . 0.0 110.113 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -87.32 -10.62 51.78 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.89 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 58.24 27.41 15.13 Favored 'General case' 0 C--N 1.345 0.371 0 C-N-CA 124.876 1.27 . . . . 0.0 111.709 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.33 166.58 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.568 0 CA-C-O 121.232 0.539 . . . . 0.0 111.688 -176.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . 0.488 ' HE1' ' SD ' ' A' ' 490' ' ' MET . 42.5 m-85 -98.49 138.57 35.52 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.005 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 58.3 ttp -133.35 143.08 48.74 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.501 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -151.89 158.94 28.05 Favored Glycine 0 N--CA 1.414 -2.77 0 C-N-CA 119.253 -1.451 . . . . 0.0 112.475 -178.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.458 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 10.3 mp -115.3 139.45 49.96 Favored 'General case' 0 C--N 1.291 -1.94 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.638 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.551 HG13 ' O ' ' A' ' 510' ' ' VAL . 4.9 tt -107.05 108.32 61.81 Favored Pre-proline 0 C--O 1.254 1.324 0 CA-C-O 120.941 0.4 . . . . 0.0 111.65 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.508 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.2 Cg_exo -72.12 138.66 31.17 Favored 'Trans proline' 0 C--O 1.294 3.294 0 C-N-CA 123.433 2.755 . . . . 0.0 113.066 172.114 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -71.3 -45.32 63.34 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 113.114 -1.857 . . . . 0.0 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.02 104.69 13.41 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.364 0.602 . . . . 0.0 111.166 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -36.07 81.12 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.626 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 80.3 p -63.71 -47.66 80.22 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -72.1 -38.74 59.32 Favored Glycine 0 N--CA 1.434 -1.477 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.432 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . 0.482 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 44.9 t80 -71.05 -47.36 58.94 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.245 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.55 -38.53 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.318 0.58 . . . . 0.0 109.61 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -59.59 -41.47 90.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.809 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -67.85 -41.81 87.58 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.176 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.513 ' O ' HG13 ' A' ' 541' ' ' ILE . 47.6 mm -61.55 -36.7 74.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 122.492 0.317 . . . . 0.0 110.433 177.534 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -56.39 -38.69 71.82 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.863 0.363 . . . . 0.0 110.525 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -67.3 -41.8 84.79 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 54.4 t -63.28 -43.87 98.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.118 178.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 537' ' ' ILE . 71.9 mt -59.98 -44.58 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.464 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 83.4 m -62.84 -38.94 92.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.741 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -67.55 -38.21 83.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.087 0.47 . . . . 0.0 110.026 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.57 -27.53 68.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.988 178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.94 -27.96 63.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.068 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.39 -43.25 27.99 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 175.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 54.7 84.07 0.07 Allowed 'General case' 0 C--O 1.242 0.689 0 C-N-CA 125.284 1.433 . . . . 0.0 112.473 174.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -90.63 88.48 7.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -83.13 146.0 28.9 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 176.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -59.14 -52.95 63.49 Favored 'General case' 0 C--N 1.317 -0.839 0 O-C-N 123.628 0.58 . . . . 0.0 110.367 178.138 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 . . . . . 0 C--O 1.247 0.935 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 177.103 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 15.7 m 74.32 -62.69 0.45 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.805 1.242 . . . . 0.0 112.342 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 47.7 t 64.02 95.55 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.725 1.21 . . . . 0.0 110.768 -177.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 396' ' ' SER . . . . . 0.417 ' HB2' ' O ' ' A' ' 398' ' ' LYS . 31.7 m -95.91 177.92 5.6 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.153 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -70.16 -42.72 72.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.433 0.635 . . . . 0.0 109.47 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.417 ' O ' ' HB2' ' A' ' 396' ' ' SER . 63.6 mttp -111.42 160.94 16.63 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 171.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . 0.457 HD13 ' CD2' ' A' ' 435' ' ' HIS . 3.5 mp -90.33 122.49 33.27 Favored 'General case' 0 C--N 1.284 -2.256 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.096 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 60.0 tp -62.36 116.35 4.98 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 175.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.29 -52.92 2.26 Favored 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.533 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 51.4 t90 -146.34 133.66 20.65 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 118.85 -1.14 . . . . 0.0 112.71 -170.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 38.5 t -111.2 119.94 40.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.533 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.08 -173.46 26.53 Favored Glycine 0 N--CA 1.426 -1.974 0 C-N-CA 119.411 -1.376 . . . . 0.0 112.43 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.2 142.44 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.048 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . 0.414 HD12 ' CE1' ' A' ' 473' ' ' PHE . 88.9 mt -112.67 138.49 49.39 Favored 'General case' 0 C--N 1.293 -1.868 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.501 ' CG ' ' HB3' ' A' ' 426' ' ' SER . 26.3 mt-10 -115.67 125.73 53.23 Favored 'General case' 0 N--CA 1.402 -2.858 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.979 175.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -123.7 148.8 46.22 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.374 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -140.36 143.64 35.84 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.07 172.87 7.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.02 0.438 . . . . 0.0 111.396 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -120.59 110.79 35.18 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.74 -56.53 0.39 Allowed 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 121.872 1.715 . . . . 0.0 108.907 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 164.5 140.72 0.03 OUTLIER Pre-proline 0 CA--C 1.508 -0.638 0 C-N-CA 127.68 2.392 . . . . 0.0 104.731 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -61.98 107.55 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 121.353 1.369 . . . . 0.0 110.315 173.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -92.43 -8.78 43.78 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.065 0.936 . . . . 0.0 108.652 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.3 t -140.38 -165.78 1.99 Allowed 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 7.5 p -73.62 -36.39 47.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.089 0.471 . . . . 0.0 110.467 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -95.37 118.65 32.5 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.43 -3.72 58.77 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -84.9 78.42 9.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.168 0.985 . . . . 0.0 111.469 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 5.9 t -131.85 72.9 1.51 Allowed 'General case' 0 N--CA 1.418 -2.034 0 CA-C-O 122.975 1.369 . . . . 0.0 109.268 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -167.54 165.22 14.72 Favored 'General case' 0 N--CA 1.426 -1.674 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 93.4 mt -115.44 152.4 32.97 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' THR . . . . . 0.429 HG21 ' HB3' ' A' ' 407' ' ' GLU . 5.7 m -78.85 130.27 35.49 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . 0.402 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 31.0 mmt180 -119.46 146.68 45.2 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.155 -177.879 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.501 ' HB3' ' CG ' ' A' ' 407' ' ' GLU . 2.9 p -110.84 139.94 45.72 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -173.139 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . 0.402 HD11 HD21 ' A' ' 483' ' ' LEU . 77.2 mt -137.12 125.09 14.5 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.985 175.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.23 146.62 32.07 Favored 'Trans proline' 0 C--O 1.248 0.979 0 C-N-CA 122.707 2.271 . . . . 0.0 111.605 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 21.7 p -147.49 167.46 24.4 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.817 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -116.48 129.89 56.46 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 41.4 t -124.87 123.85 66.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.923 0 CA-C-O 121.988 0.899 . . . . 0.0 112.18 -175.762 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -109.13 158.6 17.63 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.494 HG11 HG13 ' A' ' 471' ' ' VAL . 27.8 m -121.77 139.82 47.66 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.994 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.574 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 48.6 t30 -95.72 131.83 41.57 Favored 'General case' 1 C--O 1.308 4.158 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 174.202 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . 0.475 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 29.1 m-70 -37.41 153.19 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 O-C-N 127.773 3.171 . . . . 0.0 116.448 -167.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.54 -2.42 30.77 Favored Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.929 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . 0.475 ' OE1' ' HA ' ' A' ' 435' ' ' HIS . 1.0 OUTLIER -82.36 161.08 22.66 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 124.281 1.032 . . . . 0.0 112.638 -173.712 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -146.02 96.05 2.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.618 167.031 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . 0.443 HD21 HG21 ' A' ' 441' ' ' THR . 0.0 OUTLIER -140.34 141.37 35.67 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.088 175.175 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -104.06 106.85 17.5 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 105.107 -2.183 . . . . 0.0 105.107 166.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.443 HG21 HD21 ' A' ' 439' ' ' LEU . 8.1 p -70.13 -12.68 61.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.021 0.915 . . . . 0.0 112.588 -175.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -68.49 -22.75 64.53 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.63 174.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -103.58 12.52 34.88 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 122.305 1.05 . . . . 0.0 108.982 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 9.9 m0 -93.57 140.55 23.16 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -70.89 144.83 49.05 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 122.042 1.828 . . . . 0.0 109.045 171.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -81.35 -5.25 57.65 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.918 0.39 . . . . 0.0 111.183 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -128.25 120.19 26.66 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.994 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.33 147.18 41.82 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.9 mm -99.23 123.2 51.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.815 0.34 . . . . 0.0 110.207 -175.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.26 135.41 53.87 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.109 0.48 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . 0.568 ' HB3' ' SG ' ' A' ' 497' ' ' CYS . 8.1 tp-100 -117.83 131.13 56.6 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.546 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.94 125.07 33.8 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.9 pt -134.2 159.86 70.73 Favored Pre-proline 0 C--N 1.317 -0.839 0 C-N-CA 123.218 0.607 . . . . 0.0 110.16 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -64.11 129.31 23.98 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 121.861 1.707 . . . . 0.0 112.1 176.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.55 -29.52 70.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.676 0.79 . . . . 0.0 111.386 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -57.75 -41.2 81.41 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.132 0.491 . . . . 0.0 111.93 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 73.8 mt -76.16 -8.73 57.69 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.568 -173.781 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 51.1 tp -70.15 -16.79 63.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.582 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.5 t -60.5 -25.18 65.89 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-O 121.026 0.441 . . . . 0.0 111.316 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 5.3 m -71.31 -19.33 62.33 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.438 0.695 . . . . 0.0 110.652 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.0 4.27 52.78 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.999 0.428 . . . . 0.0 111.443 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.32 -54.23 3.28 Favored Glycine 0 CA--C 1.548 2.129 0 CA-C-N 114.319 -1.31 . . . . 0.0 115.583 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.5 -20.84 51.26 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 122.914 2.409 . . . . 0.0 114.723 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.72 -36.96 59.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.835 -0.54 . . . . 0.0 110.884 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -68.97 -13.21 62.31 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.865 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.61 -36.13 79.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.85 89.02 3.03 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 109.592 175.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.3 m -144.14 160.17 41.38 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.342 -178.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -111.23 141.93 44.1 Favored 'General case' 0 C--N 1.284 -2.269 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.574 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 72.4 mtp -98.39 153.01 18.88 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 118.036 -1.466 . . . . 0.0 112.159 -170.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.494 HG13 HG11 ' A' ' 433' ' ' VAL . 22.1 m -134.18 162.15 39.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.596 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -133.29 123.08 24.84 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 173.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . 0.414 ' CE1' HD12 ' A' ' 406' ' ' LEU . 17.2 m-85 -107.72 134.39 50.76 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.898 0.749 . . . . 0.0 110.068 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -133.93 123.51 24.81 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 172.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -87.34 152.84 21.93 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 121.204 -0.198 . . . . 0.0 110.761 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 10.9 t -76.96 119.03 20.13 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.843 0.83 . . . . 0.0 109.211 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -80.26 38.18 0.41 Allowed 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.125 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -84.48 -36.67 22.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.24 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -115.11 87.57 2.68 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.79 -28.94 68.79 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.676 -177.357 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -70.64 -41.7 71.82 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 9.3 t -67.75 -43.07 80.74 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.438 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 83.8 mt -64.69 -30.16 71.17 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.84 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.461 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 88.0 tttt -54.99 -47.27 74.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.115 0.566 . . . . 0.0 110.817 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -64.38 -42.04 97.85 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.957 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.8 tt -65.03 -45.05 87.06 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . 0.438 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -60.31 -40.3 90.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.285 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . 0.537 ' HA ' ' CZ ' ' A' ' 488' ' ' ARG . 2.6 mmp_? -62.92 -50.28 71.46 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.714 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 76.3 mt -57.71 -45.47 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 122.703 0.401 . . . . 0.0 110.649 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 19.0 mmt -63.92 -43.87 94.59 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.312 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.93 -22.59 74.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.337 -0.392 . . . . 0.0 112.335 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -76.76 -7.02 54.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.822 0.449 . . . . 0.0 111.641 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.4 30.4 6.96 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 119.373 -1.394 . . . . 0.0 112.482 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.73 162.24 13.7 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -125.18 158.35 34.19 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -117.41 108.24 1.67 Allowed Glycine 0 N--CA 1.426 -1.988 0 C-N-CA 120.3 -0.952 . . . . 0.0 111.601 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . 0.568 ' SG ' ' HB3' ' A' ' 451' ' ' GLN . 10.6 p -83.87 118.55 24.04 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.4 121.28 55.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.17 136.09 50.74 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.219 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -97.64 133.46 23.54 Favored Pre-proline 0 C--N 1.291 -1.959 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.73 92.3 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.838 0 N-CA-C 107.909 -1.612 . . . . 0.0 107.909 169.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -77.47 130.48 37.06 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -170.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 4.2 m -84.12 -49.77 8.56 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.614 177.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.44 147.79 50.69 Favored Pre-proline 0 N--CA 1.439 -1.014 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.372 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -90.27 -22.17 0.8 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 122.172 1.914 . . . . 0.0 113.547 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 14.4 t -117.07 19.31 14.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.836 0.827 . . . . 0.0 108.975 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -160.19 164.38 32.88 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 48.0 t 75.55 97.54 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 107.416 -1.328 . . . . 0.0 107.416 -172.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . 0.545 ' HB3' ' O ' ' A' ' 527' ' ' PRO . 11.1 mmt180 -98.06 -166.76 1.42 Allowed 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.091 -168.097 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.497 ' O ' HG21 ' A' ' 526' ' ' ILE . 22.6 m -121.53 163.07 19.93 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.151 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.944 -177.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.543 ' HB2' HG12 ' A' ' 526' ' ' ILE . 14.4 tp -130.91 145.81 52.13 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -170.46 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 32.4 tpp -113.42 120.71 41.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.308 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 45.9 tp -105.87 126.8 52.61 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.226 0.536 . . . . 0.0 110.076 -179.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 80.7 mt -132.36 148.75 52.43 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.435 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.25 128.65 52.02 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-O 120.702 0.286 . . . . 0.0 110.773 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 18.8 m -107.86 110.66 22.49 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.5 p -68.18 -35.87 78.71 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 124.43 1.092 . . . . 0.0 113.218 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.86 -33.38 66.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -97.39 -3.65 39.86 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.42 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 24.9 tptp 59.67 36.62 22.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.795 1.238 . . . . 0.0 111.298 177.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -140.66 165.59 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.981 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.044 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 39.7 m-85 -103.39 132.52 49.58 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.0 ptm -110.8 157.6 19.61 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.443 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -164.23 143.59 8.69 Favored Glycine 0 N--CA 1.405 -3.418 0 C-N-CA 119.094 -1.527 . . . . 0.0 112.021 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . 0.47 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 11.0 mp -114.92 137.74 51.63 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 172.626 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.543 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.8 mt -107.11 106.97 59.75 Favored Pre-proline 0 N--CA 1.428 -1.551 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.545 ' O ' ' HB3' ' A' ' 509' ' ' ARG . 29.4 Cg_exo -70.32 134.01 25.82 Favored 'Trans proline' 0 C--O 1.292 3.212 0 C-N-CA 123.186 2.591 . . . . 0.0 112.189 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -76.78 -27.43 55.28 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 113.37 -1.741 . . . . 0.0 112.058 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.04 90.11 7.99 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -66.82 -33.69 76.17 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.926 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.4 p -58.27 -48.32 80.81 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -174.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.76 -34.36 43.69 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.801 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 51.6 t80 -68.52 -47.7 66.27 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -177.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . 0.505 ' O ' ' HG3' ' A' ' 538' ' ' ARG . 89.6 t -62.65 -40.69 89.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 O-C-N 123.352 0.407 . . . . 0.0 110.22 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -57.64 -45.93 84.82 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . 0.44 ' O ' HG22 ' A' ' 540' ' ' VAL . . . -69.18 -44.95 63.7 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.73 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 41.8 mm -63.32 -34.07 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 122.558 0.343 . . . . 0.0 111.754 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 534' ' ' VAL . 56.9 mtp180 -56.17 -46.77 79.22 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.94 -39.94 95.31 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.742 0.651 . . . . 0.0 109.57 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . 0.44 HG22 ' O ' ' A' ' 536' ' ' GLY . 97.7 t -60.86 -48.09 90.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.553 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 79.5 mt -61.81 -45.47 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.07 0.462 . . . . 0.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 54.3 m -62.06 -40.37 95.55 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.647 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -67.69 -36.77 81.29 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -62.66 -36.08 81.7 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.27 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.63 -49.29 22.08 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -73.81 -49.01 27.27 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 68.37 -72.8 0.09 Allowed 'General case' 0 C--O 1.239 0.539 0 C-N-CA 125.117 1.367 . . . . 0.0 111.86 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 64.72 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 124.742 1.217 . . . . 0.0 109.897 -172.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -157.75 127.98 6.24 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -86.41 81.53 8.29 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 122.155 0.978 . . . . 0.0 111.499 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 . . . . . 0 C--N 1.299 -1.6 0 CA-C-N 115.033 -0.985 . . . . 0.0 108.603 -179.806 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 20.3 ptp . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 121.276 0.56 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 50.6 m -115.31 2.7 14.06 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 121.365 0.603 . . . . 0.0 110.306 177.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 28.3 t -94.93 9.18 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-O 122.215 1.007 . . . . 0.0 108.708 -176.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 12.1 m -63.52 -29.58 70.82 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.809 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -171.29 -70.38 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 398' ' ' LYS . . . . . 0.431 ' O ' ' HD3' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -114.76 142.05 47.03 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.578 178.234 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 399' ' ' LEU . . . . . 0.511 HD12 ' HD1' ' A' ' 435' ' ' HIS . 2.4 mp -108.84 119.34 39.25 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 67.1 tp -69.02 121.46 16.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -120.67 -46.02 2.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -176.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 402' ' ' TRP . . . . . 0.499 ' CZ2' ' HA2' ' A' ' 404' ' ' GLY . 41.7 t90 -150.05 149.23 30.03 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.385 -174.182 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 10.3 p -133.66 117.71 17.32 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 173.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 404' ' ' GLY . . . . . 0.499 ' HA2' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.75 -172.29 25.67 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.306 -173.218 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 405' ' ' VAL . . . . . 0.455 HG11 ' HB2' ' A' ' 426' ' ' SER . 58.2 t -114.98 142.65 27.02 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 CA-C-O 121.023 0.44 . . . . 0.0 109.924 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 89.1 mt -113.05 133.36 55.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 407' ' ' GLU . . . . . 0.436 ' HG2' HG21 ' A' ' 424' ' ' THR . 38.3 tt0 -116.29 134.41 54.93 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 408' ' ' TRP . . . . . 0.441 ' HB3' ' HB2' ' A' ' 450' ' ' MET . 14.4 p-90 -143.22 155.58 44.55 Favored 'General case' 0 C--O 1.252 1.214 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -173.282 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -109.53 157.57 18.87 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.696 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 410' ' ' GLU . . . . . 0.514 ' HB2' HH21 ' A' ' 425' ' ' ARG . 33.4 tt0 -121.89 -89.88 0.59 Allowed 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -92.69 161.94 30.62 Favored Pre-proline 0 C--O 1.22 -0.492 0 O-C-N 122.122 -0.361 . . . . 0.0 110.05 -175.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 121.524 1.482 . . . . 0.0 110.502 173.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -114.91 122.45 33.59 Favored Pre-proline 0 N--CA 1.446 -0.653 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -77.81 -56.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.321 2.014 . . . . 0.0 112.279 -175.6 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -93.32 1.55 56.92 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.175 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.8 m 71.08 -46.64 0.64 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.212 1.405 . . . . 0.0 111.547 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 35.2 m -75.15 -16.64 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.639 0.733 . . . . 0.0 109.07 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -99.67 137.27 38.38 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 419' ' ' ALA . . . . . 0.404 ' HB2' ' CE1' ' A' ' 551' ' ' HIS . . . -88.11 -26.15 22.64 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -170.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -128.88 117.42 20.99 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -171.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 24.3 m -78.42 85.61 4.51 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.454 0.645 . . . . 0.0 109.96 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.61 6.08 44.05 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.331 0.586 . . . . 0.0 110.315 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -81.38 105.49 12.61 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' THR . . . . . 0.436 HG21 ' HG2' ' A' ' 407' ' ' GLU . 2.4 m -107.48 116.82 32.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' ARG . . . . . 0.514 HH21 ' HB2' ' A' ' 410' ' ' GLU . 0.0 OUTLIER -110.41 157.03 19.99 Favored 'General case' 0 C--N 1.278 -2.501 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.116 -176.97 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' SER . . . . . 0.455 ' HB2' HG11 ' A' ' 405' ' ' VAL . 60.4 p -131.65 159.27 38.81 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -170.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 50.8 mt -127.09 135.32 27.22 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.651 0.78 . . . . 0.0 110.021 -176.259 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -82.47 132.6 6.92 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.821 2.347 . . . . 0.0 112.208 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 23.7 p -143.71 163.85 32.12 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.377 0.608 . . . . 0.0 112.212 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -116.77 130.06 56.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 43.0 t -117.64 123.78 72.19 Favored 'Isoleucine or valine' 0 C--O 1.268 2.059 0 CA-C-O 122.071 0.938 . . . . 0.0 110.768 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -109.88 158.24 18.39 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.436 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' VAL . . . . . 0.431 HG13 HG11 ' A' ' 471' ' ' VAL . 33.4 m -121.67 141.52 41.77 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.37 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' ASN . . . . . 0.508 ' HB2' ' CB ' ' A' ' 470' ' ' MET . 11.7 m120 -94.51 130.28 40.98 Favored 'General case' 1 C--O 1.308 4.147 0 N-CA-C 103.3 -2.852 . . . . 0.0 103.3 163.927 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' HIS . . . . . 0.511 ' HD1' HD12 ' A' ' 399' ' ' LEU 0.309 31.6 p-80 -63.47 -175.91 0.14 Allowed 'General case' 0 N--CA 1.426 -1.641 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 -160.919 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.44 -11.25 33.28 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 105.337 -3.105 . . . . 0.0 105.337 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -128.91 149.02 50.96 Favored 'General case' 0 N--CA 1.383 -3.811 0 C-N-CA 127.306 2.242 . . . . 0.0 105.958 177.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -161.73 102.88 1.18 Allowed 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -137.82 151.9 48.57 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.647 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -94.6 123.09 37.83 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 170.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' THR . . . . . 0.458 HG23 ' HB2' ' A' ' 402' ' ' TRP . 11.7 p -83.45 38.12 0.6 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -170.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -75.64 -23.74 56.37 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.89 0.853 . . . . 0.0 109.079 175.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -88.48 -0.78 57.58 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.541 -177.166 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -99.71 131.5 24.58 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.826 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' PRO . . . . . 0.402 ' HG3' ' OG1' ' A' ' 503' ' ' THR . 18.8 Cg_exo -69.18 162.76 40.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.73 1.62 . . . . 0.0 108.965 172.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -80.45 -7.23 59.07 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.068 -0.395 . . . . 0.0 110.849 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.436 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 56.4 mtpt -126.97 126.95 44.06 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.996 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 64.2 mt -113.26 148.46 35.52 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.881 177.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.38 122.8 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 -173.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' MET . . . . . 0.441 ' HB2' ' HB3' ' A' ' 408' ' ' TRP . 79.9 mtp -100.14 118.5 36.61 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.642 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -110.81 113.87 26.79 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.1 mt -76.49 127.25 32.47 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 31.3 pt -136.59 161.6 60.98 Favored Pre-proline 0 C--N 1.309 -1.177 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.42 128.85 15.02 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 CA-C-N 120.109 1.075 . . . . 0.0 111.569 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -62.97 -26.35 68.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.164 0.986 . . . . 0.0 110.698 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -57.48 -38.63 74.83 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.649 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 63.9 mt -87.06 -2.06 58.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.954 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.8 tt -72.78 -24.19 60.9 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.302 0.641 . . . . 0.0 111.284 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.5 m -57.03 -31.51 65.23 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.675 0.79 . . . . 0.0 112.045 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.8 m -71.86 -18.04 62.09 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 121.3 0.571 . . . . 0.0 111.951 -177.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.18 0.85 52.68 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.851 -0.531 . . . . 0.0 111.539 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . 0.41 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -39.7 -52.32 3.12 Favored Glycine 0 CA--C 1.551 2.288 0 CA-C-N 114.4 -1.273 . . . . 0.0 115.355 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' PRO . . . . . 0.41 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 6.8 Cg_endo -50.25 -33.17 35.45 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.534 2.823 . . . . 0.0 114.021 178.222 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.64 -38.42 65.02 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 110.18 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -69.04 -13.62 62.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.537 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.23 -11.61 59.61 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.568 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.17 92.05 2.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.277 1.037 . . . . 0.0 108.995 171.273 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 61.7 m -148.14 169.86 19.08 Favored 'General case' 0 N--CA 1.422 -1.868 0 CA-C-O 121.987 0.898 . . . . 0.0 111.922 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -111.29 142.16 43.88 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 126.739 2.016 . . . . 0.0 107.384 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' MET . . . . . 0.508 ' CB ' ' HB2' ' A' ' 434' ' ' ASN . 2.7 mmm -97.62 148.84 22.89 Favored 'General case' 0 CA--C 1.483 -1.628 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.673 -173.464 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.433 HG21 ' O ' ' A' ' 524' ' ' GLY . 21.4 m -138.32 151.6 24.91 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -127.01 128.89 47.06 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -107.77 116.54 32.14 Favored 'General case' 0 C--O 1.271 2.226 0 CA-C-O 121.867 0.841 . . . . 0.0 110.419 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -123.57 122.57 38.52 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 105.898 -1.889 . . . . 0.0 105.898 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -89.89 157.94 17.66 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 19.1 p -71.99 -74.71 0.15 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . 0.448 ' C ' ' H ' ' A' ' 479' ' ' ASP . 84.2 m-20 -91.51 144.17 25.83 Favored 'General case' 0 CA--C 1.444 -3.114 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 165.723 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 483' ' ' LEU . 1.4 mppt? -74.76 -2.16 25.25 Favored 'General case' 0 C--N 1.264 -3.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 108.666 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' ASP . . . . . 0.448 ' H ' ' C ' ' A' ' 477' ' ' ASN . 8.5 t70 42.71 68.14 0.53 Allowed 'General case' 0 CA--C 1.46 -2.513 0 C-N-CA 126.875 2.07 . . . . 0.0 107.166 -178.768 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 27.4 mt -47.2 -34.03 5.95 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 109.89 -3.323 . . . . 0.0 115.185 -166.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.22 -51.53 20.65 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 118.944 0.793 . . . . 0.0 110.929 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 17.9 m -71.27 -47.55 56.28 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -173.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' LEU . . . . . 0.525 ' HB2' ' O ' ' A' ' 478' ' ' LYS . 8.0 mp -73.87 -19.27 60.77 Favored 'General case' 0 C--O 1.193 -1.878 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.389 -177.493 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -62.52 -34.43 76.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.621 0.724 . . . . 0.0 109.158 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' GLY . . . . . 0.406 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -69.77 -47.13 50.04 Favored Glycine 0 N--CA 1.438 -1.205 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.872 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -39.21 90.71 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.942 0.897 . . . . 0.0 111.729 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' TYR . . . . . 0.453 ' CE1' ' HB3' ' A' ' 483' ' ' LEU . 6.0 m-30 -61.19 -40.36 93.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.631 0.373 . . . . 0.0 110.369 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -67.13 -38.23 85.2 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.088 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 485' ' ' GLY . 64.0 mt -64.19 -49.51 80.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.08 0.466 . . . . 0.0 110.149 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 15.4 mmt -63.85 -35.5 80.83 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.29 -14.38 81.97 Favored Glycine 0 CA--C 1.527 0.828 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.078 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -84.17 -0.91 53.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.585 0.707 . . . . 0.0 109.676 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.89 29.99 6.99 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.861 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -107.02 161.6 14.59 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 120.945 0.403 . . . . 0.0 111.139 176.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -136.28 160.11 39.71 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -120.49 106.04 1.13 Allowed Glycine 0 N--CA 1.423 -2.221 0 C-N-CA 119.712 -1.233 . . . . 0.0 111.33 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' CYS . . . . . 0.418 ' SG ' HG22 ' A' ' 537' ' ' ILE . 49.9 t -82.88 123.38 29.33 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.95 120.85 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.131 0 CA-C-O 121.477 0.656 . . . . 0.0 110.165 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -107.74 143.48 36.2 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.562 -1.199 . . . . 0.0 108.377 176.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -98.68 129.77 29.34 Favored Pre-proline 0 C--N 1.285 -2.211 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.634 -175.341 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -60.03 162.55 16.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 122.402 2.068 . . . . 0.0 110.845 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -77.44 120.79 22.92 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.168 0.509 . . . . 0.0 111.191 -173.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' THR . . . . . 0.402 ' OG1' ' HG3' ' A' ' 445' ' ' PRO . 49.6 m -152.41 -45.89 0.1 Allowed 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.231 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.02 154.75 75.99 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.196 173.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -55.17 -33.45 84.27 Favored 'Trans proline' 0 N--CA 1.488 1.176 0 C-N-CA 122.91 2.407 . . . . 0.0 113.715 -176.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 36.3 t -178.89 -48.33 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -81.1 104.05 11.32 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.233 177.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.6 p -111.63 -26.62 3.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.436 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 73.86 149.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.986 1.314 . . . . 0.0 109.222 -178.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.544 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.5 m -122.38 160.15 24.84 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.041 0 C-N-CA 117.326 -1.75 . . . . 0.0 111.883 -174.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.523 ' HB2' HG12 ' A' ' 526' ' ' ILE . 13.5 tp -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -170.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 43.0 tpp -109.56 114.4 28.0 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 44.8 tp -101.35 123.98 46.3 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.264 0.554 . . . . 0.0 110.037 -178.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 72.7 mt -126.35 148.87 49.5 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.311 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -97.96 130.48 44.81 Favored 'General case' 0 C--N 1.273 -2.72 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.301 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 46.1 t -102.5 109.97 21.77 Favored 'General case' 0 N--CA 1.411 -2.379 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 33.7 p -69.64 -19.81 63.61 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.531 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -65.52 -44.32 87.32 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.037 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -105.85 -9.86 16.97 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.426 -177.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 69.14 28.72 4.9 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.084 0.954 . . . . 0.0 110.737 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -134.62 168.82 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.835 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.022 -175.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -104.67 139.61 39.26 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.203 -172.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 22.9 mmt -124.17 160.31 28.14 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' GLY . . . . . 0.433 ' O ' HG21 ' A' ' 471' ' ' VAL . . . -170.89 153.6 21.13 Favored Glycine 0 N--CA 1.416 -2.634 0 C-N-CA 118.805 -1.664 . . . . 0.0 112.823 177.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -114.69 140.02 49.19 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 172.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.523 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.0 mt -108.21 107.6 60.35 Favored Pre-proline 0 N--CA 1.427 -1.585 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 33.5 Cg_exo -68.09 133.86 30.05 Favored 'Trans proline' 0 C--O 1.296 3.388 0 C-N-CA 122.441 2.094 . . . . 0.0 112.846 171.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.2 -35.2 68.87 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 113.092 -1.867 . . . . 0.0 106.848 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.11 65.73 0.81 Allowed 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.291 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -66.78 -38.04 85.77 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.59 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 12.2 m -63.81 -41.6 97.85 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 -177.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.42 -42.9 21.48 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.0 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -64.33 -47.47 79.26 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.197 0.199 . . . . 0.0 111.337 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.97 -39.04 82.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.02 -37.64 87.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.368 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -72.41 -47.3 29.2 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.385 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' ILE . . . . . 0.418 HG22 ' SG ' ' A' ' 497' ' ' CYS . 38.9 mm -62.97 -33.92 63.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 122.963 0.505 . . . . 0.0 111.837 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -56.14 -42.08 76.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 122.922 0.489 . . . . 0.0 110.034 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -66.2 -41.56 90.02 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.811 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 71.7 t -60.89 -44.87 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.043 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' ILE . . . . . 0.504 ' O ' ' HG3' ' A' ' 545' ' ' GLU . 90.3 mt -62.4 -45.72 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.84 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' THR . . . . . 0.408 ' HA ' ' OE2' ' A' ' 545' ' ' GLU . 19.0 m -67.48 -36.54 81.32 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.412 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -66.94 -37.03 83.56 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 177.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.56 -41.53 97.52 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.795 174.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 47.2 mt-10 -62.55 -27.97 69.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.195 0.521 . . . . 0.0 111.268 178.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -83.4 -48.17 10.64 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.279 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -67.03 -44.45 80.19 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.448 -176.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -106.82 99.22 8.81 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.636 0.255 . . . . 0.0 110.336 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 45.2 p-80 -132.58 82.92 2.03 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 122.201 1.001 . . . . 0.0 110.032 174.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -92.61 -17.59 24.16 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.04 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' HIS . . . . . 0.404 ' CE1' ' HB2' ' A' ' 419' ' ' ALA . 21.9 t-80 . . . . . 0 N--CA 1.425 -1.723 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 398' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.311 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 399' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 399' ' ' LEU . 2.9 mp -102.03 134.52 45.12 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -174.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.77 124.72 27.76 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.03 -41.24 2.77 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.456 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 54.9 t90 -148.8 149.71 31.82 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -173.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.6 m -138.98 117.67 12.24 Favored 'General case' 0 C--N 1.275 -2.643 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.456 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -160.58 -172.46 27.87 Favored Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.8 t -108.98 142.11 22.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -175.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.444 ' HG ' ' SG ' ' A' ' 429' ' ' CYS . 86.0 mt -113.12 141.46 46.88 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.503 ' OE2' ' HG2' ' A' ' 447' ' ' LYS . 35.8 mt-10 -116.04 125.18 52.1 Favored 'General case' 0 N--CA 1.405 -2.688 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 174.939 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 408' ' ' TRP . . . . . 0.44 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 64.9 p-90 . . . . . 0 N--CA 1.425 -1.692 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.452 -173.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 425' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 38.1 mmt180 . . . . . 0 CA--C 1.499 -0.999 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 27.7 p -108.89 144.84 36.28 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 123.635 0.584 . . . . 0.0 110.987 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 20.9 tp -146.97 126.89 6.7 Favored Pre-proline 0 C--N 1.305 -1.363 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.97 142.05 24.59 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.396 2.064 . . . . 0.0 112.17 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 429' ' ' CYS . . . . . 0.444 ' SG ' ' HG ' ' A' ' 406' ' ' LEU . 26.0 p -144.29 163.49 33.56 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.376 0.608 . . . . 0.0 111.78 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -117.25 129.18 55.75 Favored 'General case' 0 N--CA 1.423 -1.792 0 N-CA-C 104.404 -2.443 . . . . 0.0 104.404 174.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 48.0 t -117.17 125.29 73.86 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.973 0 CA-C-O 121.794 0.807 . . . . 0.0 110.384 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -108.04 160.98 15.37 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 30.5 m -121.25 141.29 42.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.148 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.709 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 53.8 t30 -94.1 131.31 39.75 Favored 'General case' 1 C--O 1.359 6.855 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 173.952 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -38.43 148.1 0.05 OUTLIER 'General case' 0 C--N 1.363 1.161 3 O-C-N 130.865 5.103 . . . . 0.0 118.987 -161.856 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.51 -18.44 35.34 Favored Glycine 0 CA--C 1.494 -1.273 0 CA-C-N 112.528 -2.124 . . . . 0.0 110.858 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.606 ' OE2' ' HA ' ' A' ' 469' ' ' ARG . 5.6 mm-40 -98.07 118.0 33.69 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 114.329 -0.936 . . . . 0.0 110.806 -170.262 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -108.73 108.45 19.28 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -138.23 156.02 48.08 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -102.39 121.38 42.21 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-O 121.316 0.579 . . . . 0.0 111.034 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.402 HG21 ' HB2' ' A' ' 402' ' ' TRP . 4.3 p -88.71 -13.59 39.29 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -174.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.96 -19.01 65.72 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.567 0.699 . . . . 0.0 109.626 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -82.1 -10.87 59.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.448 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -84.0 141.76 40.99 Favored Pre-proline 0 C--O 1.245 0.864 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -67.31 163.18 35.48 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.567 2.178 . . . . 0.0 109.799 171.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -81.84 -9.93 59.47 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.503 ' HG2' ' OE2' ' A' ' 407' ' ' GLU . 1.8 mptm? -124.47 135.99 53.67 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.915 172.641 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 448' ' ' LEU . . . . . 0.43 HD22 ' CD1' ' A' ' 500' ' ' PHE . 56.3 mt -118.5 146.69 44.33 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 59.1 mt -98.82 116.93 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 22.5 ptm -122.87 134.32 54.39 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.429 0.633 . . . . 0.0 112.186 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -116.71 133.82 55.55 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.52 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -81.58 110.37 16.89 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.296 0.569 . . . . 0.0 110.013 177.307 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 2.4 pp -118.4 152.95 51.59 Favored Pre-proline 0 C--N 1.301 -1.519 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.713 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.96 128.69 20.24 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 121.032 1.155 . . . . 0.0 113.159 -177.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.27 -25.88 68.52 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.137 1.375 . . . . 0.0 110.595 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -57.28 -41.16 79.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.461 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 8.3 mp -85.88 -8.89 57.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.984 0.421 . . . . 0.0 111.219 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.49 -20.0 55.01 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.201 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 11.4 m -57.52 -28.72 63.74 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.015 0.926 . . . . 0.0 110.489 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.55 -22.42 65.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.094 -177.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.59 9.64 42.8 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.653 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -42.7 -55.89 4.49 Favored Glycine 0 CA--C 1.543 1.835 0 N-CA-C 116.31 1.284 . . . . 0.0 116.31 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.75 -19.79 59.22 Favored 'Trans proline' 0 C--N 1.362 1.289 0 CA-C-N 120.122 1.961 . . . . 0.0 113.17 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.22 -22.37 55.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.358 0.599 . . . . 0.0 109.997 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.0 -13.54 61.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.957 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -72.61 -9.87 59.12 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.53 81.29 1.88 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.155 0.978 . . . . 0.0 110.164 173.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 468' ' ' SER . . . . . 0.425 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 51.8 m -155.35 169.42 24.26 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.239 -175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.606 ' HA ' ' OE2' ' A' ' 437' ' ' GLU . 0.1 OUTLIER -109.79 141.72 42.04 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -176.941 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.709 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 41.1 mtp -97.7 149.04 22.72 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 113.593 -3.243 . . . . 0.0 111.347 -172.972 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 11.6 m -135.17 160.58 40.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.371 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -139.77 133.62 30.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 65.2 m-85 -107.95 125.3 51.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-O 121.628 0.728 . . . . 0.0 110.748 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -121.32 123.2 41.59 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' PHE . . . . . 0.416 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 78.1 m-85 . . . . . 0 C--N 1.287 -2.139 0 C-N-CA 119.535 -0.866 . . . . 0.0 113.075 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 85.0 mt . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -65.6 -40.64 92.9 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.622 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.8 m -66.54 -41.42 88.74 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.36 -48.18 80.92 Favored 'General case' 0 C--O 1.201 -1.495 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.777 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 37.5 ttpt -55.35 -47.03 76.34 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 123.517 0.727 . . . . 0.0 110.868 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -63.24 -43.23 98.84 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.473 HD21 ' SD ' ' A' ' 490' ' ' MET . 9.5 tt -66.28 -38.58 88.11 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 123.19 0.596 . . . . 0.0 110.91 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -56.55 -41.39 76.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.172 0.589 . . . . 0.0 110.714 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 484' ' ' LYS . 24.8 mmt180 -60.97 -47.26 87.28 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 75.9 mt -68.44 -52.8 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.981 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' MET . . . . . 0.473 ' SD ' HD21 ' A' ' 486' ' ' LEU . 87.3 mtp -76.18 -23.1 54.7 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.046 -0.662 . . . . 0.0 112.184 -175.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -81.41 -12.1 82.41 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.085 -0.578 . . . . 0.0 111.737 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -92.75 3.8 54.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.67 0.748 . . . . 0.0 110.008 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.93 30.15 6.54 Favored Glycine 0 N--CA 1.435 -1.4 0 C-N-CA 119.63 -1.271 . . . . 0.0 113.159 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -104.71 141.0 37.24 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 170.587 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' ALA . . . . . 0.42 ' HB1' ' SD ' ' A' ' 512' ' ' MET . . . -118.54 147.91 43.19 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -178.633 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -104.12 104.88 2.51 Favored Glycine 0 N--CA 1.421 -2.352 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 537' ' ' ILE . 42.1 t -82.88 119.83 24.89 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.335 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 498' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 511' ' ' LEU . 61.5 t -101.25 121.17 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.645 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -109.01 137.94 46.13 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' PHE . . . . . 0.461 ' HD2' ' O ' ' A' ' 509' ' ' ARG . 95.5 m-85 -92.49 133.82 29.05 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo . . . . . 0 C--O 1.25 1.087 0 C-N-CA 122.156 1.904 . . . . 0.0 110.604 172.426 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.409 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 31.6 t . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.461 ' O ' ' HD2' ' A' ' 500' ' ' PHE . 96.8 mtt180 -169.76 -176.95 2.52 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.193 -3.262 . . . . 0.0 102.193 -174.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.8 m -134.93 155.97 39.04 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.749 0 CA-C-N 120.832 1.651 . . . . 0.0 111.235 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.618 HD13 ' HB ' ' A' ' 526' ' ' ILE . 40.6 tp -125.52 148.84 48.74 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-O 120.899 0.38 . . . . 0.0 111.609 -172.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' MET . . . . . 0.42 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 39.0 tpp -113.78 138.76 49.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 175.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' A' ' 522' ' ' PHE . 0.9 OUTLIER -117.5 124.84 49.73 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.072 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.41 139.81 50.59 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 123.605 0.762 . . . . 0.0 109.588 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -94.27 122.94 37.33 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.926 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.9 p -105.83 110.62 22.98 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 12.4 m -68.45 -32.11 71.89 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.391 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -63.24 -41.52 99.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.845 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -94.09 -5.91 46.25 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.9 tptt 62.55 21.36 12.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.402 1.481 . . . . 0.0 110.512 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.06 167.77 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.868 -173.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 61.3 m-85 -96.46 139.41 32.6 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -128.39 165.9 19.72 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -177.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 524' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -178.39 153.7 13.32 Favored Glycine 0 N--CA 1.426 -2.01 0 C-N-CA 119.353 -1.403 . . . . 0.0 112.545 175.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.488 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 8.5 mp -115.19 140.04 49.42 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 122.344 0.258 . . . . 0.0 110.429 174.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.618 ' HB ' HD13 ' A' ' 511' ' ' LEU . 3.0 tt -109.21 108.11 60.12 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-O 120.899 0.381 . . . . 0.0 111.903 177.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.52 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 31.8 Cg_exo -69.86 140.35 42.1 Favored 'Trans proline' 0 C--O 1.283 2.766 0 C-N-CA 123.637 2.891 . . . . 0.0 112.764 171.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -70.64 -44.78 66.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 113.555 -1.657 . . . . 0.0 110.316 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -85.16 101.88 12.83 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.575 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -31.98 72.59 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.956 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 18.5 m -59.3 -48.3 82.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.8 -40.36 37.01 Favored Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.179 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.507 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 34.3 t80 -70.59 -46.82 62.7 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.647 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.97 -38.89 81.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -57.54 -46.07 84.31 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.461 0.304 . . . . 0.0 110.352 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 536' ' ' GLY . . . . . 0.408 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -64.6 -42.05 97.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.644 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 541' ' ' ILE . 48.2 mm -66.88 -35.82 75.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 122.12 0.168 . . . . 0.0 110.945 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.1 -41.35 75.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.956 0.503 . . . . 0.0 110.144 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -63.0 -45.82 90.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.655 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 536' ' ' GLY . 55.7 t -62.4 -45.9 97.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.34 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 537' ' ' ILE . 66.7 mt -65.44 -45.43 92.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 C-N-CA 122.343 0.257 . . . . 0.0 111.42 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.6 t -67.22 -35.73 80.2 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.949 -178.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -67.73 -42.16 82.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.195 0.521 . . . . 0.0 109.787 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 46.0 tp . . . . . 0 C--O 1.211 -0.935 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.67 -178.818 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 398' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.346 0 CA-C-O 120.871 0.367 . . . . 0.0 110.028 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.94 118.48 36.92 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.281 -175.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.53 126.36 27.62 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 176.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -132.55 -46.0 0.89 Allowed 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.453 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 61.4 t90 -147.81 143.42 27.47 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.376 -176.096 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 43.8 t -127.44 118.05 23.31 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.453 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -163.07 -172.51 30.65 Favored Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.968 -175.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 53.3 t -113.28 141.4 29.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.304 0.642 . . . . 0.0 109.354 -176.059 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.9 mp -114.08 140.54 48.39 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.081 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.562 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 69.0 mt-10 -115.61 126.05 53.7 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.606 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 . . . . . 0 C--N 1.287 -2.142 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.483 -178.481 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 425' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 15.4 mmm180 . . . . . 0 N--CA 1.426 -1.628 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.562 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 5.4 p -122.42 133.39 54.62 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.259 0.349 . . . . 0.0 110.825 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 95.0 mt -133.54 126.22 19.0 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.191 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.62 135.2 14.35 Favored 'Trans proline' 0 C--O 1.249 1.053 0 C-N-CA 122.263 1.975 . . . . 0.0 110.941 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 429' ' ' CYS . . . . . 0.577 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 20.8 p -143.21 167.02 23.1 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.336 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -117.13 129.64 56.1 Favored 'General case' 0 N--CA 1.413 -2.29 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 47.7 t -112.16 122.61 66.76 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-O 122.431 1.11 . . . . 0.0 109.958 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -108.72 160.22 16.13 Favored 'General case' 0 N--CA 1.397 -3.078 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 25.8 m -120.87 140.75 44.04 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.026 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.269 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.526 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 25.7 t-20 -95.72 131.03 42.43 Favored 'General case' 1 C--O 1.326 5.094 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.712 179.011 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -27.56 131.51 0.04 OUTLIER 'General case' 0 C--O 1.244 0.808 0 O-C-N 127.288 2.867 . . . . 0.0 113.576 -170.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 111.02 -3.11 28.56 Favored Glycine 0 N--CA 1.421 -2.302 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 -173.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.524 ' HB2' ' HB3' ' A' ' 469' ' ' ARG . 12.7 tt0 -115.87 111.89 21.12 Favored 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 173.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -136.44 97.68 3.64 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -139.19 157.88 45.15 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -90.42 108.0 19.5 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 175.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -74.43 31.42 0.09 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.382 1.073 . . . . 0.0 112.973 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -66.98 -46.83 73.43 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.628 1.171 . . . . 0.0 112.721 -174.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -92.88 15.23 15.28 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.876 0.37 . . . . 0.0 111.452 -176.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 8.4 m0 -76.79 129.53 78.78 Favored Pre-proline 0 C--N 1.311 -1.072 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.74 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -70.96 163.54 38.88 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.45 2.1 . . . . 0.0 109.762 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -85.68 -6.08 59.18 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 93.8 mttt -127.73 132.79 49.55 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.5 mt -118.8 146.19 45.02 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.214 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.3 128.24 55.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 80.6 mtp -100.75 125.39 47.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.262 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -107.97 113.54 26.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 7.9 mp -85.35 124.74 32.31 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.246 0.546 . . . . 0.0 111.587 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.467 HD11 ' HE1' ' A' ' 512' ' ' MET . 22.5 pt -134.5 161.04 66.08 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.456 -177.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 454' ' ' PRO . . . . . 0.425 ' HD3' HD23 ' A' ' 544' ' ' LEU . 37.3 Cg_endo -72.04 128.68 14.26 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 120.064 1.059 . . . . 0.0 112.518 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -63.7 -30.36 71.47 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.623 1.169 . . . . 0.0 110.553 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.08 -36.13 82.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.892 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 540' ' ' VAL . 34.1 tp -87.29 -5.55 58.88 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.632 0.73 . . . . 0.0 111.022 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 59.1 tp -78.01 -16.12 58.36 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.791 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 22.5 p -57.59 -29.21 64.28 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 124.101 0.96 . . . . 0.0 113.101 -174.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 21.4 m -63.18 -29.75 71.04 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-O 121.102 0.477 . . . . 0.0 110.757 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.14 7.92 29.36 Favored 'General case' 0 C--O 1.222 -0.391 0 O-C-N 122.193 -0.317 . . . . 0.0 111.55 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -46.1 -58.03 5.91 Favored Glycine 0 CA--C 1.543 1.792 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.9 -22.84 75.49 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 122.672 2.248 . . . . 0.0 113.336 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.8 tp -72.43 -29.87 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.016 0.436 . . . . 0.0 109.899 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -75.22 -13.19 60.43 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.297 -0.865 . . . . 0.0 113.073 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' ARG . . . . . 0.474 ' NE ' ' HA ' ' A' ' 466' ' ' ARG . 5.0 mmp_? -61.78 -46.2 90.6 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.106 -0.638 . . . . 0.0 111.946 -177.376 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -95.13 84.29 4.06 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.824 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' SER . . . . . 0.424 ' HB2' HD23 ' A' ' 525' ' ' LEU . 66.0 m -148.24 169.99 18.86 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.922 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.524 ' HB3' ' HB2' ' A' ' 437' ' ' GLU . 8.0 mtm180 -111.13 141.98 43.92 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 -175.742 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.545 ' HG2' ' HG ' ' A' ' 525' ' ' LEU . 47.5 mtp -99.73 152.71 19.79 Favored 'General case' 0 N--CA 1.425 -1.717 0 C-N-CA 116.837 -1.945 . . . . 0.0 110.75 -173.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 23.1 m -134.0 159.45 42.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.661 178.031 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -129.44 119.87 24.52 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.752 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -107.42 119.87 40.61 Favored 'General case' 0 C--O 1.29 3.199 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.296 -177.684 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.23 123.22 27.97 Favored 'General case' 0 N--CA 1.42 -1.96 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 174.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 41.2 m-85 . . . . . 0 C--N 1.292 -1.916 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.002 -176.471 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 20.0 mt . . . . . 0 N--CA 1.444 -0.737 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -72.23 -53.79 11.53 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.035 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 7.0 m -73.88 -47.94 34.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -172.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' LEU . . . . . 0.509 ' HB3' ' CE2' ' A' ' 487' ' ' TYR . 30.4 mt -71.07 -22.39 62.12 Favored 'General case' 0 C--O 1.19 -2.029 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -174.96 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -55.81 -42.65 75.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -70.0 -44.5 61.07 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.13 175.803 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -41.67 97.23 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 487' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 483' ' ' LEU . 7.0 m-30 -56.23 -42.36 77.14 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.393 0.677 . . . . 0.0 109.774 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.29 -48.05 79.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.197 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 68.6 mt -62.2 -50.54 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 123.577 0.548 . . . . 0.0 111.341 -178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 91.6 mmm -63.65 -43.01 98.02 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.363 0.601 . . . . 0.0 110.427 -177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -70.34 -12.8 69.88 Favored Glycine 0 CA--C 1.521 0.464 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.685 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -88.5 11.04 18.18 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.287 1.041 . . . . 0.0 109.201 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.91 30.07 6.94 Favored Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.106 177.205 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -113.38 145.16 41.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 117.098 0.449 . . . . 0.0 111.367 176.217 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -124.46 153.47 41.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -114.16 107.39 1.85 Allowed Glycine 0 N--CA 1.422 -2.24 0 C-N-CA 120.34 -0.933 . . . . 0.0 111.204 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 49.5 t -82.42 121.04 26.21 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.0 t -100.8 120.8 50.79 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.197 0 CA-C-O 121.687 0.756 . . . . 0.0 109.588 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -107.6 143.23 36.35 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.84 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -100.19 129.26 28.57 Favored Pre-proline 0 C--N 1.284 -2.268 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.61 -176.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo . . . . . 0 C--O 1.245 0.858 0 N-CA-C 107.19 -1.889 . . . . 0.0 107.19 169.175 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p . . . . . 0 N--CA 1.434 -1.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.484 ' HG2' ' HA ' ' A' ' 528' ' ' TYR . 4.7 mtm180 72.69 165.47 0.29 Allowed 'General case' 0 C--N 1.373 1.612 0 C-N-CA 124.853 1.261 . . . . 0.0 109.071 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 15.9 m -128.63 163.92 32.0 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.945 0 C-N-CA 117.766 -1.574 . . . . 0.0 111.404 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.551 ' HB2' HG12 ' A' ' 526' ' ' ILE . 12.3 tp -125.88 145.87 50.07 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.279 0.561 . . . . 0.0 112.346 -173.206 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 512' ' ' MET . . . . . 0.467 ' HE1' HD11 ' A' ' 453' ' ' ILE . 38.5 tpp -115.24 117.81 31.55 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 174.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.533 HD11 ' HB3' ' A' ' 522' ' ' PHE . 48.3 tp -100.03 121.17 40.96 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 121.239 0.542 . . . . 0.0 109.995 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.17 130.02 51.81 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.45 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -90.13 127.45 36.1 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.8 p -101.46 110.76 22.81 Favored 'General case' 0 N--CA 1.401 -2.876 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 7.9 m -68.5 -34.36 75.76 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.197 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -74.46 -27.9 60.8 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.743 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -99.0 -9.89 23.37 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 120.461 -0.496 . . . . 0.0 109.861 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 59.74 31.01 20.59 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.467 1.107 . . . . 0.0 111.797 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -144.82 167.48 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.533 ' HB3' HD11 ' A' ' 513' ' ' LEU . 30.1 m-85 -102.56 138.33 39.61 Favored 'General case' 0 N--CA 1.42 -1.936 0 C-N-CA 119.321 -0.952 . . . . 0.0 110.283 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 25.8 ptm -127.01 159.57 33.73 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -165.89 153.08 22.79 Favored Glycine 0 N--CA 1.42 -2.38 0 C-N-CA 118.437 -1.839 . . . . 0.0 112.67 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.545 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 9.6 mp -115.58 139.21 50.3 Favored 'General case' 0 C--N 1.29 -1.987 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 171.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 511' ' ' LEU . 25.0 mt -105.67 107.46 59.41 Favored Pre-proline 0 N--CA 1.428 -1.558 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 25.4 Cg_exo -70.93 138.0 33.2 Favored 'Trans proline' 0 C--O 1.295 3.359 0 C-N-CA 123.027 2.485 . . . . 0.0 112.316 171.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' TYR . . . . . 0.484 ' HA ' ' HG2' ' A' ' 509' ' ' ARG . 96.9 m-85 -71.65 -41.43 68.79 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 113.3 -1.773 . . . . 0.0 110.28 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.48 89.71 3.84 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -67.5 -44.98 77.18 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.71 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.1 m -60.36 -46.85 88.47 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 112.818 0.674 . . . . 0.0 112.818 -174.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -75.85 -38.48 36.18 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.453 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 537' ' ' ILE . 46.4 t80 -63.98 -47.57 79.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 93.5 t -61.45 -38.85 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 121.09 0.471 . . . . 0.0 110.038 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -62.44 -41.18 98.55 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.352 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.99 -41.15 93.37 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 533' ' ' PHE . 46.7 mm -62.72 -35.52 71.05 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 122.757 0.423 . . . . 0.0 111.122 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -55.92 -38.59 70.46 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.05 0.452 . . . . 0.0 111.301 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -68.99 -44.27 73.2 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.301 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 457' ' ' LEU . 48.6 t -62.39 -42.26 94.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.176 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 537' ' ' ILE . 73.8 mt -60.54 -45.14 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.328 0.651 . . . . 0.0 109.708 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 60.2 m -58.7 -41.53 86.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.112 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -68.11 -42.93 79.53 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.455 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.425 HD23 ' HD3' ' A' ' 454' ' ' PRO . 2.8 tm? . . . . . 0 N--CA 1.469 0.511 0 C-N-CA 123.659 0.784 . . . . 0.0 111.726 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 398' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.493 -1.249 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 399' ' ' LEU . . . . . 0.402 ' HB2' HG23 ' A' ' 433' ' ' VAL . 2.9 mp -106.16 132.47 52.19 Favored 'General case' 0 C--N 1.265 -3.091 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -175.297 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.58 128.87 37.59 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -118.59 -62.88 1.48 Allowed 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.472 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 52.1 t90 -140.11 145.95 38.25 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.357 -171.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 20.6 t -126.26 121.52 32.91 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.472 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -169.56 -172.09 35.82 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.443 -175.131 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 49.7 t -109.55 139.23 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 448' ' ' LEU . 9.2 tp -113.91 132.2 56.01 Favored 'General case' 0 N--CA 1.409 -2.514 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -115.62 125.85 53.44 Favored 'General case' 0 N--CA 1.419 -2.012 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 . . . . . 0 C--N 1.296 -1.745 0 CA-C-O 121.04 0.447 . . . . 0.0 111.143 -171.688 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 . . . . . 0 C--O 1.211 -0.931 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 46.9 p -125.46 131.53 52.84 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.926 0.393 . . . . 0.0 111.484 -175.115 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 427' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 482' ' ' SER . 62.1 mt -136.16 127.38 16.94 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 122.754 0.422 . . . . 0.0 111.977 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -73.43 134.47 20.74 Favored 'Trans proline' 0 C--O 1.254 1.312 0 C-N-CA 122.385 2.056 . . . . 0.0 110.791 175.222 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.3 p -141.91 161.54 37.71 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.694 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -116.98 129.78 56.26 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.36 124.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.795 0 CA-C-O 121.739 0.78 . . . . 0.0 110.502 -175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -107.86 155.37 20.35 Favored 'General case' 0 C--N 1.28 -2.428 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 471' ' ' VAL . 18.1 m -122.27 139.31 49.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.635 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 37.0 t30 -98.33 130.86 45.0 Favored 'General case' 1 C--O 1.309 4.219 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.502 168.703 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.485 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 80.0 m80 -19.53 152.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 131.166 3.786 . . . . 0.0 118.201 -170.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 110.76 -1.16 28.89 Favored Glycine 0 C--O 1.244 0.769 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.488 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.567 ' HG3' HG21 ' A' ' 433' ' ' VAL . 0.0 OUTLIER -97.19 146.31 25.2 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -174.063 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -155.95 93.41 1.44 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 160.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -142.26 146.4 35.09 Favored 'General case' 0 C--N 1.281 -2.385 0 CA-C-N 114.09 -1.413 . . . . 0.0 107.539 174.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 440' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 19.4 ptmt -102.25 129.41 48.64 Favored 'General case' 0 C--N 1.282 -2.359 0 C-N-CA 118.665 -1.214 . . . . 0.0 110.185 175.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.448 HG21 ' HB2' ' A' ' 402' ' ' TRP . 8.0 p -83.56 1.15 43.46 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.086 0.946 . . . . 0.0 111.435 -175.758 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.08 -30.12 71.21 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.687 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 443' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 440' ' ' LYS . 27.0 pt20 -101.29 17.22 23.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.627 -176.932 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -95.94 141.84 23.73 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.257 177.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.85 163.04 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.187 1.925 . . . . 0.0 109.74 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . 0.308 2.7 pp0? -97.55 -7.78 30.54 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 14.0 mptt -127.88 113.77 16.33 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.786 0.834 . . . . 0.0 109.67 169.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 448' ' ' LEU . . . . . 0.551 ' HB2' HD12 ' A' ' 406' ' ' LEU . 50.3 mt -103.38 147.12 27.5 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 46.5 mm -99.35 122.52 51.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 120.887 0.375 . . . . 0.0 110.543 -174.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.424 ' SD ' HD23 ' A' ' 513' ' ' LEU . 57.9 ttp -112.08 121.82 46.04 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 451' ' ' GLN . . . . . 0.454 ' HB2' ' SG ' ' A' ' 497' ' ' CYS . 12.4 mm-40 -106.91 133.62 51.29 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 489' ' ' ILE . 88.1 mt -91.29 115.87 28.37 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.473 0.654 . . . . 0.0 111.391 -177.076 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.448 ' HA ' HD11 ' A' ' 544' ' ' LEU . 39.6 pt -116.9 161.76 30.79 Favored Pre-proline 0 C--N 1.311 -1.077 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.078 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 454' ' ' PRO . . . . . 0.451 ' HD3' HD11 ' A' ' 544' ' ' LEU . 8.4 Cg_exo -71.54 129.68 16.09 Favored 'Trans proline' 0 C--O 1.244 0.806 0 C-N-CA 121.464 1.443 . . . . 0.0 110.919 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -62.75 -28.15 69.77 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.5 0.72 . . . . 0.0 111.148 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' GLN . . . . . 0.41 ' CD ' ' H ' ' A' ' 456' ' ' GLN . 19.3 mp0 -63.89 -40.7 97.13 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.132 -176.906 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.8 mt -77.81 -11.47 59.89 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.198 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.1 tp -82.69 -19.33 38.32 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.0 m -58.28 -28.55 65.06 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 122.959 0.503 . . . . 0.0 111.134 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 15.7 m -61.37 -27.62 68.65 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.195 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.07 8.42 37.86 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.628 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 462' ' ' GLY . . . . . 0.426 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -45.96 -52.25 10.08 Favored Glycine 0 CA--C 1.545 1.933 0 N-CA-C 114.891 0.716 . . . . 0.0 114.891 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 463' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 11.8 Cg_endo -56.14 -28.62 71.3 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.88 2.387 . . . . 0.0 113.405 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 42.4 tp -75.93 -29.89 58.53 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.202 0.525 . . . . 0.0 110.762 -177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -72.99 -12.61 61.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.183 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -68.83 -20.48 64.31 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.777 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -127.21 84.66 2.28 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.334 0.588 . . . . 0.0 109.482 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.4 m -158.15 170.32 22.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 -178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -110.45 143.75 40.28 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 124.326 1.051 . . . . 0.0 109.61 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.635 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 32.2 mmm -96.39 152.06 18.95 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -165.522 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 433' ' ' VAL . 4.8 m -142.27 162.08 19.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -133.84 130.03 37.32 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -110.95 117.62 33.87 Favored 'General case' 0 C--O 1.274 2.389 0 CA-C-O 121.734 0.778 . . . . 0.0 111.015 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -114.51 122.71 47.4 Favored 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 173.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 C--N 1.288 -2.073 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.66 -177.462 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 79.1 mt . . . . . 0 C--O 1.214 -0.804 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -69.53 -42.33 74.79 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.275 0.559 . . . . 0.0 110.865 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' SER . . . . . 0.484 ' HB3' HD21 ' A' ' 427' ' ' LEU . 8.5 t -72.22 -38.35 69.0 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.76 -43.78 97.89 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.276 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -55.04 -43.04 73.4 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.312 0.645 . . . . 0.0 110.587 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.499 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.96 -46.44 59.49 Favored Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 42.4 tp -58.41 -44.3 88.96 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 123.544 0.737 . . . . 0.0 111.267 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -60.35 -40.33 90.34 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 122.654 0.382 . . . . 0.0 111.16 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -66.58 -44.04 83.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.018 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 452' ' ' LEU . 66.2 mt -65.78 -44.4 93.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.159 0.504 . . . . 0.0 109.834 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.4 mmt -63.87 -43.01 97.37 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.041 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.16 -15.36 69.74 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.215 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -84.72 -4.24 58.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.396 0.617 . . . . 0.0 109.891 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.56 30.42 6.54 Favored Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.104 -1.046 . . . . 0.0 113.739 177.353 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -103.4 161.75 13.58 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.64 0.257 . . . . 0.0 110.342 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -127.95 153.12 47.07 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -112.31 107.53 2.07 Favored Glycine 0 N--CA 1.424 -2.152 0 C-N-CA 120.203 -0.998 . . . . 0.0 112.4 -177.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 451' ' ' GLN . 17.6 p -84.44 117.32 23.57 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.13 120.41 50.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.881 0 CA-C-O 121.962 0.887 . . . . 0.0 109.303 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -112.81 143.24 44.39 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 113.145 -1.843 . . . . 0.0 107.763 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' PHE . . . . . 0.435 ' CD2' HG11 ' A' ' 508' ' ' VAL . 15.8 m-85 -98.68 126.48 38.81 Favored Pre-proline 0 C--N 1.268 -2.969 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo . . . . . 0 C--O 1.244 0.819 0 C-N-CA 122.536 2.157 . . . . 0.0 112.992 -177.176 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.435 HG11 ' CD2' ' A' ' 500' ' ' PHE . 4.6 t . . . . . 0 N--CA 1.423 -1.82 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.624 ' HD2' ' O ' ' A' ' 528' ' ' TYR . 19.4 mmt180 -81.2 171.15 15.23 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.547 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 24.2 m -109.44 165.87 5.12 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.402 0 C-N-CA 117.966 -1.494 . . . . 0.0 112.077 -171.982 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.567 ' HB2' HG12 ' A' ' 526' ' ' ILE . 1.0 OUTLIER -133.01 134.42 44.42 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.118 -177.505 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 512' ' ' MET . . . . . 0.416 ' N ' HD22 ' A' ' 511' ' ' LEU . 35.0 tpp -102.46 121.36 42.19 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.011 -0.736 . . . . 0.0 109.011 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 522' ' ' PHE . 31.8 tp -106.95 125.29 50.81 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.622 0.725 . . . . 0.0 110.523 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 59.4 mt -124.28 148.83 47.12 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.237 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -100.04 124.0 44.92 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.359 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 34.8 p -93.9 110.42 22.09 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 173.261 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.8 p -68.92 -35.49 76.87 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.352 -1.294 . . . . 0.0 113.061 -175.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -72.92 -24.17 60.78 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.65 0.738 . . . . 0.0 110.327 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -105.24 -9.81 17.45 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.257 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 61.09 24.13 14.26 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.736 1.214 . . . . 0.0 111.598 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -133.0 167.65 26.17 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.687 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' A' ' 513' ' ' LEU . 24.4 m-85 -102.31 138.87 38.68 Favored 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.314 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -133.81 141.63 47.53 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' GLY . . . . . 0.403 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -152.69 159.12 28.27 Favored Glycine 0 N--CA 1.431 -1.663 0 C-N-CA 118.861 -1.637 . . . . 0.0 113.465 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.55 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.6 mp -115.6 139.96 49.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 173.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 511' ' ' LEU . 12.4 mt -97.97 107.98 43.73 Favored Pre-proline 0 C--O 1.249 1.072 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 177.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 525' ' ' LEU . 23.8 Cg_exo -72.06 133.13 20.85 Favored 'Trans proline' 0 C--O 1.294 3.301 0 C-N-CA 123.231 2.621 . . . . 0.0 112.289 171.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 528' ' ' TYR . . . . . 0.624 ' O ' ' HD2' ' A' ' 509' ' ' ARG . 70.4 m-85 -74.89 -41.3 60.02 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.571 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -84.03 91.95 7.75 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.944 0.878 . . . . 0.0 110.184 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -37.34 83.13 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 114.201 -1.363 . . . . 0.0 113.138 179.104 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 22.6 t -61.0 -47.71 85.21 Favored 'General case' 0 C--O 1.243 0.763 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -175.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.68 -36.54 37.22 Favored Glycine 0 N--CA 1.437 -1.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.818 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 537' ' ' ILE . 50.2 t80 -66.22 -47.34 74.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 88.2 t -65.24 -38.36 82.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.052 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -59.17 -38.56 80.06 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.38 0.61 . . . . 0.0 110.187 176.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -70.53 -46.3 48.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 533' ' ' PHE . 51.6 mm -67.33 -36.15 75.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -56.33 -43.19 78.8 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -59.64 -40.45 87.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.647 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 56.5 t -67.28 -46.56 83.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.066 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.433 ' O ' ' HB2' ' A' ' 544' ' ' LEU . 77.0 mt -62.71 -45.25 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-O 121.302 0.572 . . . . 0.0 109.935 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 21.8 m -63.37 -33.56 75.81 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.907 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -64.63 -44.08 91.66 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 173.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.451 HD11 ' HD3' ' A' ' 454' ' ' PRO . 96.8 mt . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 123.486 0.714 . . . . 0.0 111.733 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 398' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.18 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mp -112.6 137.05 51.42 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.59 125.14 22.92 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -111.9 -64.65 1.26 Allowed 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.09 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.587 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 69.1 t90 -161.61 150.09 15.53 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -169.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.5 m -129.47 117.82 21.13 Favored 'General case' 0 C--N 1.276 -2.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.587 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -155.1 -172.39 22.73 Favored Glycine 0 N--CA 1.424 -2.15 0 C-N-CA 119.752 -1.213 . . . . 0.0 113.152 -174.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 428' ' ' PRO . 61.6 t -109.28 140.71 26.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.133 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 84.4 mt -113.26 128.14 56.38 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -117.21 126.08 52.2 Favored 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -177.144 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 . . . . . 0 C--N 1.309 -1.162 0 C-N-CA 123.36 0.664 . . . . 0.0 110.085 -174.343 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.443 -0.811 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 56.3 p -123.13 130.1 52.32 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 121.134 -0.226 . . . . 0.0 110.863 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 427' ' ' LEU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 428' ' ' PRO . 92.5 mt -130.55 125.94 21.78 Favored Pre-proline 0 C--N 1.316 -0.861 0 O-C-N 123.192 0.308 . . . . 0.0 111.094 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 428' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 427' ' ' LEU . 8.7 Cg_exo -75.84 142.34 25.29 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.043 2.496 . . . . 0.0 112.182 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 429' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 475' ' ' PHE . 23.1 p -141.13 168.57 19.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.2 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -115.7 129.53 56.51 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 104.953 -2.239 . . . . 0.0 104.953 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.8 t -122.79 123.92 69.33 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 CA-C-O 121.874 0.845 . . . . 0.0 110.274 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 432' ' ' TYR . . . . . 0.474 ' HB2' ' HB3' ' A' ' 472' ' ' GLN . 78.0 m-85 -118.54 161.0 20.75 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.506 HG12 HG12 ' A' ' 471' ' ' VAL . 6.2 m -121.86 140.22 46.5 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.501 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 434' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -96.07 132.96 40.9 Favored 'General case' 0 C--O 1.297 3.553 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.267 172.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -25.15 157.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 129.94 3.296 . . . . 0.0 117.385 -171.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.08 -2.43 35.34 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -172.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.537 ' HA ' ' CZ ' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -101.77 161.46 13.64 Favored 'General case' 0 N--CA 1.406 -2.648 0 CA-C-N 113.12 -1.54 . . . . 0.0 114.584 -174.822 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 51.0 t30 178.81 94.01 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 168.797 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -142.72 157.56 44.53 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.919 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -99.71 132.0 45.33 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.419 ' HA ' ' CD1' ' A' ' 444' ' ' TRP . 17.7 p -101.74 19.11 18.79 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.235 0.54 . . . . 0.0 111.965 -177.564 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -75.8 -27.53 57.98 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.511 0.672 . . . . 0.0 111.609 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -94.57 8.43 42.28 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.33 1.062 . . . . 0.0 109.855 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 444' ' ' TRP . . . . . 0.419 ' CD1' ' HA ' ' A' ' 441' ' ' THR . 12.7 m0 -80.18 121.1 81.46 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.468 177.055 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.98 149.47 70.46 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.55 2.167 . . . . 0.0 110.194 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -74.15 -22.53 59.4 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 123.066 0.546 . . . . 0.0 110.229 -174.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -124.35 123.84 41.08 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.555 173.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 90.2 mt -106.29 146.94 29.75 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 51.4 mm -98.53 119.12 46.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.508 ' SD ' HD23 ' A' ' 513' ' ' LEU . 54.2 ttp -113.33 129.7 56.46 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.347 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 451' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 451' ' ' GLN . 14.8 mm-40 -119.0 130.93 55.94 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.486 HD13 HG21 ' A' ' 489' ' ' ILE . 77.9 mt -84.54 123.71 30.6 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.233 -176.489 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 30.9 pt -128.61 158.03 73.24 Favored Pre-proline 0 C--N 1.305 -1.355 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.51 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -63.57 130.15 27.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 121.865 1.71 . . . . 0.0 111.312 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 458' ' ' LEU . 21.1 tm0? -62.3 -29.93 70.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.249 0.62 . . . . 0.0 111.667 -177.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -60.27 -31.08 69.89 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -79.29 -12.75 59.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.218 0.533 . . . . 0.0 111.096 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 455' ' ' GLN . 4.2 tt -73.74 -22.18 59.96 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 124.036 0.934 . . . . 0.0 110.938 -178.357 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 41.7 p -58.42 -19.72 38.64 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 14.6 t -70.76 -21.14 62.55 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.279 0.561 . . . . 0.0 110.905 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 86.4 mt -88.62 11.05 18.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.127 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.19 -58.43 5.08 Favored Glycine 0 CA--C 1.548 2.115 0 CA-C-O 119.38 -0.678 . . . . 0.0 114.469 178.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.27 -24.44 78.85 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.899 2.4 . . . . 0.0 112.693 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.0 tp -75.46 -46.44 32.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.223 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -70.69 -14.77 62.58 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -71.95 -17.13 62.1 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.813 0.339 . . . . 0.0 111.054 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -126.78 76.83 1.67 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' SER . . . . . 0.413 ' HA ' ' CE2' ' A' ' 528' ' ' TYR . 69.3 m -152.8 170.99 18.96 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.926 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.537 ' CZ ' ' HA ' ' A' ' 437' ' ' GLU . 6.5 ptp180 -111.69 144.04 41.61 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 125.889 1.676 . . . . 0.0 109.039 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' MET . . . . . . . . . . . . . 27.3 mmm -95.4 152.61 18.24 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.405 -167.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 524' ' ' GLY . 16.8 m -127.14 162.08 32.91 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.275 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 472' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 432' ' ' TYR . 7.1 tp-100 -133.51 119.95 20.19 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.406 ' HE1' HG21 ' A' ' 471' ' ' VAL . 30.4 m-85 -115.36 126.44 54.43 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-O 121.594 0.711 . . . . 0.0 111.57 -178.212 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.97 123.19 26.86 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 174.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 429' ' ' CYS . 56.4 m-85 . . . . . 0 C--N 1.294 -1.82 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.83 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 93.6 mt . . . . . 0 N--CA 1.446 -0.656 0 CA-C-O 120.983 0.42 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 484' ' ' LYS . 29.3 mm-40 -71.09 -45.02 64.51 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.9 m -63.87 -37.16 86.36 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.279 0.561 . . . . 0.0 109.527 176.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 483' ' ' LEU . . . . . 0.517 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 85.2 mt -64.57 -36.8 85.4 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.991 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 481' ' ' GLU . 36.9 ttpt -54.44 -44.49 72.53 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.715 0.806 . . . . 0.0 110.649 -178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -69.3 -43.52 70.13 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.092 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.88 -42.48 97.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.897 0.479 . . . . 0.0 110.081 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' TYR . . . . . 0.517 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -58.49 -40.41 82.69 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.689 0.396 . . . . 0.0 111.351 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -67.28 -37.68 83.83 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.2 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.486 HG21 HD13 ' A' ' 452' ' ' LEU . 65.6 mt -68.24 -45.58 82.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.1 mmt -63.62 -37.31 86.84 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.529 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.31 -9.95 84.35 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.344 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -92.53 8.52 38.49 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.774 0.797 . . . . 0.0 109.943 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 91.61 29.66 11.74 Favored Glycine 0 C--O 1.245 0.804 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.889 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -109.24 157.03 19.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -128.24 160.51 31.89 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -118.15 109.1 1.74 Allowed Glycine 0 N--CA 1.421 -2.319 0 C-N-CA 120.004 -1.094 . . . . 0.0 111.461 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 19.6 p -82.39 120.55 25.58 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.6 t -102.35 120.2 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.723 0 CA-C-O 121.489 0.661 . . . . 0.0 109.411 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' HIS . . . . . 0.4 ' NE2' HG22 ' A' ' 534' ' ' VAL . 42.3 m80 -112.01 137.48 49.97 Favored 'General case' 0 N--CA 1.418 -2.044 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.783 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -98.95 114.81 65.83 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.535 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo . . . . . 0 N--CA 1.457 -0.662 0 C-N-CA 122.153 1.902 . . . . 0.0 108.593 175.998 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 33.6 t . . . . . 0 N--CA 1.431 -1.385 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.402 ' H ' ' NE ' ' A' ' 509' ' ' ARG . 0.1 OUTLIER -56.75 150.83 15.28 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 124.268 0.98 . . . . 0.0 110.389 -175.82 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.563 ' O ' HG13 ' A' ' 526' ' ' ILE . 12.5 m -118.33 159.03 19.02 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.734 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 6.4 tt -135.35 147.11 48.99 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.119 -1.032 . . . . 0.0 112.747 -167.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 53.2 tpp -106.42 124.62 49.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -104.17 127.31 51.76 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.536 0.684 . . . . 0.0 110.354 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -130.72 148.68 52.54 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.664 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -102.37 129.13 48.75 Favored 'General case' 0 C--N 1.277 -2.548 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 176.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.7 t -104.92 110.7 23.18 Favored 'General case' 0 N--CA 1.414 -2.246 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 11.7 t -69.73 -22.43 63.38 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.165 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -62.66 -43.38 98.96 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.945 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.02 -4.75 24.18 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.306 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 59.99 30.02 19.55 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.616 1.166 . . . . 0.0 111.492 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -140.96 168.71 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.948 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.651 ' HB3' HD11 ' A' ' 513' ' ' LEU . 44.3 m-85 -96.41 139.26 32.78 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -138.05 166.51 23.92 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 123.689 0.796 . . . . 0.0 109.485 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' GLY . . . . . 0.509 ' O ' HG22 ' A' ' 471' ' ' VAL . . . 178.86 167.29 36.25 Favored Glycine 0 N--CA 1.42 -2.369 0 C-N-CA 119.135 -1.507 . . . . 0.0 111.745 178.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.451 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.1 mp -114.94 140.66 48.83 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 170.373 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.563 HG13 ' O ' ' A' ' 510' ' ' VAL . 6.7 tt -103.38 107.86 57.22 Favored Pre-proline 0 C--N 1.299 -1.599 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.568 175.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.557 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 32.5 Cg_exo -66.33 132.21 28.81 Favored 'Trans proline' 0 C--O 1.282 2.689 0 C-N-CA 123.315 2.677 . . . . 0.0 113.286 172.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 528' ' ' TYR . . . . . 0.43 ' HE1' ' CZ ' ' A' ' 469' ' ' ARG . 43.3 m-85 -72.26 -38.98 68.73 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 113.175 -1.83 . . . . 0.0 109.094 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.35 87.29 6.6 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.428 -174.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.61 -34.53 78.1 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.741 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.8 p -58.92 -46.45 87.91 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.467 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.65 -34.76 52.98 Favored Glycine 0 N--CA 1.429 -1.774 0 CA-C-N 116.292 -0.413 . . . . 0.0 113.254 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.494 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 73.5 t80 -70.54 -47.64 59.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.295 0.548 . . . . 0.0 110.556 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 534' ' ' VAL . . . . . 0.4 HG22 ' NE2' ' A' ' 499' ' ' HIS . 99.1 t -64.79 -37.82 81.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.002 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -59.54 -48.17 82.7 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.58 89.16 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.283 -0.484 . . . . 0.0 112.197 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.42 ' O ' HG13 ' A' ' 541' ' ' ILE . 39.9 mm -68.27 -22.15 27.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.619 -0.291 . . . . 0.0 111.326 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -60.58 -40.44 91.69 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.12 -0.363 . . . . 0.0 110.657 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.81 -38.02 89.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.94 -49.96 77.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.854 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 537' ' ' ILE . 81.8 mt -60.68 -45.96 96.66 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 123.18 0.592 . . . . 0.0 111.676 -178.295 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.7 t -65.93 -38.49 88.79 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.262 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.7 -41.4 79.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.246 176.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 CA--C 1.541 0.635 0 C-N-CA 122.92 0.488 . . . . 0.0 110.361 -178.701 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.434 -1.231 0 CA-C-O 121.094 0.473 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 4.3 mp -101.98 137.66 39.97 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.063 -175.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.25 115.45 7.72 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 175.236 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.66 -54.59 2.47 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.548 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 74.4 t90 -159.45 144.95 15.87 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.187 -171.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 45.7 m -130.0 120.89 25.49 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 174.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.548 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -156.48 -171.67 22.98 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -174.021 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -121.28 142.57 36.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-N 116.909 0.354 . . . . 0.0 110.148 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.665 HD13 ' SG ' ' A' ' 429' ' ' CYS . 9.8 mp -112.76 139.06 48.7 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.442 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 65.5 mt-10 -115.02 152.43 32.46 Favored 'General case' 0 C--O 1.254 1.34 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.141 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.443 0 C-N-CA 125.972 1.709 . . . . 0.0 108.997 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 . . . . . 0 N--CA 1.422 -1.872 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.442 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 57.5 p -144.48 159.76 42.22 Favored 'General case' 0 C--N 1.259 -3.357 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.208 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 427' ' ' LEU . . . . . 0.425 HD21 HD23 ' A' ' 483' ' ' LEU . 22.6 tp -146.55 117.36 4.72 Favored Pre-proline 0 N--CA 1.412 -2.367 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.181 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.51 132.29 23.42 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.61 2.207 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 429' ' ' CYS . . . . . 0.665 ' SG ' HD13 ' A' ' 406' ' ' LEU . 0.0 OUTLIER -125.8 157.73 36.78 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.011 -175.515 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -116.89 128.92 55.71 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 170.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 28.5 t -120.33 122.98 69.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.899 0 CA-C-O 122.137 0.97 . . . . 0.0 110.218 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.09 155.09 26.61 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 471' ' ' VAL . 26.2 m -122.33 140.74 45.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.405 0 C-N-CA 119.739 -0.785 . . . . 0.0 111.264 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.65 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 27.0 t-20 -95.2 132.24 40.37 Favored 'General case' 1 C--O 1.324 4.998 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.337 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -34.35 161.42 0.0 OUTLIER 'General case' 0 C--N 1.361 1.1 0 O-C-N 127.824 3.203 . . . . 0.0 116.66 -171.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 106.59 -3.01 36.61 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -174.128 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -99.65 161.9 13.34 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.601 1.16 . . . . 0.0 113.978 -174.699 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -165.25 95.66 0.67 Allowed 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 165.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -140.81 141.49 34.73 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.071 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -96.45 118.2 32.46 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.498 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 402' ' ' TRP . 43.5 p -81.21 5.19 17.76 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.784 0.802 . . . . 0.0 111.099 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -59.04 -32.0 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.907 1.283 . . . . 0.0 109.943 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.81 4.58 51.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.297 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 18.4 m0 -92.78 126.25 52.43 Favored Pre-proline 0 C--N 1.308 -1.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.855 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.19 162.93 33.7 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.303 2.002 . . . . 0.0 110.474 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -75.58 -26.31 57.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 120.836 0.35 . . . . 0.0 111.044 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -113.98 130.95 56.49 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.666 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 39.4 mt -118.84 147.83 43.52 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.206 176.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 58.3 mt -98.33 123.64 50.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 65.8 ttp -100.47 132.54 45.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -124.25 115.91 21.81 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.459 HD13 HG21 ' A' ' 489' ' ' ILE . 89.2 mt -88.55 116.25 26.66 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.328 0.585 . . . . 0.0 110.728 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.0 pt -119.87 161.66 37.02 Favored Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 125.033 1.333 . . . . 0.0 108.52 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -67.48 129.58 20.46 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 121.393 1.395 . . . . 0.0 111.008 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -62.58 -36.59 83.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 123.789 0.836 . . . . 0.0 111.566 -174.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -66.35 -20.93 66.22 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.473 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.92 -3.92 59.13 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 122.144 -0.348 . . . . 0.0 111.507 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.5 tp -82.06 -16.23 50.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.201 0.524 . . . . 0.0 110.99 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 31.4 m -57.49 -25.68 60.15 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.068 0.947 . . . . 0.0 112.805 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 16.7 p -70.55 -18.97 62.93 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.763 -0.586 . . . . 0.0 111.795 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 92.9 mt -99.75 10.54 41.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.299 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -47.88 -54.98 10.43 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-O 119.399 -0.667 . . . . 0.0 114.038 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.98 -20.19 59.1 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 122.759 2.306 . . . . 0.0 113.272 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.81 -35.65 43.86 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -69.39 -13.06 62.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.323 0.649 . . . . 0.0 112.379 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -57.57 -30.46 65.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -127.02 97.12 4.83 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' SER . . . . . 0.561 ' HB2' HD23 ' A' ' 525' ' ' LEU . 75.1 m -156.46 172.1 19.12 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 123.66 0.784 . . . . 0.0 110.013 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 437' ' ' GLU . 48.8 mtm180 -109.42 142.06 40.94 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.65 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 71.0 mmm -96.37 142.43 28.5 Favored 'General case' 0 CA--C 1.492 -1.264 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.19 -168.425 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 433' ' ' VAL . 4.9 m -131.59 153.56 38.98 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -132.08 127.04 35.24 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 24.3 m-85 -111.47 125.9 54.38 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.347 -177.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -130.04 127.77 40.6 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 172.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' PHE . . . . . 0.503 ' HB2' HD21 ' A' ' 483' ' ' LEU . 90.5 m-85 . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.229 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 483' ' ' LEU . 63.4 mt . . . . . 0 C--O 1.211 -0.932 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -61.11 -51.28 69.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.027 0.205 . . . . 0.0 110.753 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 30.2 m -64.06 -36.67 84.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 483' ' ' LEU . . . . . 0.503 HD21 ' HB2' ' A' ' 475' ' ' PHE . 79.0 mt -69.1 -48.89 61.43 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.66 -45.41 73.85 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.293 1.037 . . . . 0.0 111.101 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.464 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.83 -44.92 66.76 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.57 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -62.66 -43.66 98.24 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -58.38 -42.48 87.16 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.244 0.618 . . . . 0.0 110.513 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -67.72 -44.62 77.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.96 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 485' ' ' GLY . 72.9 mt -64.44 -47.9 87.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 490' ' ' MET . . . . . 0.45 ' HB3' ' HB3' ' A' ' 515' ' ' TYR . 17.5 mmt -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.787 0.327 . . . . 0.0 111.086 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.04 -15.09 69.14 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.606 -178.305 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -85.46 2.5 44.34 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.687 0.795 . . . . 0.0 109.712 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.36 30.92 6.36 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 119.452 -1.356 . . . . 0.0 112.774 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -111.63 162.22 15.41 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 122.603 -0.351 . . . . 0.0 110.843 176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -133.73 158.84 42.28 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.48 107.17 1.32 Allowed Glycine 0 N--CA 1.422 -2.245 0 C-N-CA 119.968 -1.111 . . . . 0.0 112.074 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 38.7 t -85.91 121.52 28.66 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' VAL . . . . . 0.415 ' HB ' ' HG ' ' A' ' 511' ' ' LEU . 73.2 t -102.21 120.57 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 122.078 0.942 . . . . 0.0 109.896 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 499' ' ' HIS . . . . . 0.44 ' NE2' HG22 ' A' ' 534' ' ' VAL . 29.9 m80 -110.09 143.22 40.46 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.591 -178.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -99.03 141.73 23.39 Favored Pre-proline 0 C--N 1.266 -3.042 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo . . . . . 0 C--O 1.247 0.955 0 C-N-CA 121.85 1.7 . . . . 0.0 108.519 171.623 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.417 -2.123 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 528' ' ' TYR . 6.6 mpt_? -116.45 174.37 6.1 Favored 'General case' 0 C--N 1.281 -2.413 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.9 m -126.84 164.09 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 C-N-CA 118.687 -1.205 . . . . 0.0 108.266 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.554 ' HB3' HG12 ' A' ' 526' ' ' ILE . 1.3 pp -137.74 151.02 47.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 117.111 -1.836 . . . . 0.0 111.92 -175.994 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' MET . . . . . 0.501 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 35.4 tpp -104.77 134.59 47.65 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 522' ' ' PHE . 58.1 tp -119.39 120.34 36.61 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 123.399 0.68 . . . . 0.0 109.994 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 62.5 mt -129.03 146.12 51.08 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.301 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.45 ' HB3' ' HB3' ' A' ' 490' ' ' MET . 33.5 t80 -99.09 123.57 43.48 Favored 'General case' 0 C--N 1.282 -2.361 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 178.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 516' ' ' SER . . . . . 0.443 ' OG ' ' HD3' ' A' ' 519' ' ' LYS . 38.3 t -99.24 111.16 23.6 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 174.557 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 40.5 m -67.83 -29.25 68.36 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.416 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -75.02 -40.41 60.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.322 0.582 . . . . 0.0 109.694 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' LYS . . . . . 0.443 ' HD3' ' OG ' ' A' ' 516' ' ' SER . 3.8 mptp? -85.83 -9.91 56.26 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.22 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.4 tptt 63.5 24.28 14.0 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.206 1.402 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.37 167.73 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.961 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 30.9 m-85 -97.09 139.02 33.71 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 56.4 ttp -138.94 148.66 43.83 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -160.55 170.82 36.6 Favored Glycine 0 N--CA 1.421 -2.34 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.589 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.561 HD23 ' HB2' ' A' ' 468' ' ' SER . 7.3 mp -115.59 139.98 49.6 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.554 HG12 ' HB3' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -103.59 108.08 58.25 Favored Pre-proline 0 C--N 1.298 -1.667 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.862 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 37.5 Cg_exo -69.07 133.6 27.26 Favored 'Trans proline' 0 C--O 1.295 3.327 0 C-N-CA 123.852 3.035 . . . . 0.0 114.504 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' TYR . . . . . 0.58 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 49.4 m-85 -65.68 -45.38 83.08 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 112.541 -2.118 . . . . 0.0 111.776 -176.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -99.51 119.09 37.47 Favored 'General case' 0 CA--C 1.491 -1.327 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.844 -173.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -66.56 -41.86 87.98 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.349 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 44.3 t -65.91 -48.07 72.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -65.57 -43.6 94.25 Favored Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 121.404 -0.427 . . . . 0.0 112.802 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.15 -47.4 57.98 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.436 -177.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' VAL . . . . . 0.44 HG22 ' NE2' ' A' ' 499' ' ' HIS . 93.7 t -64.62 -38.98 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 110.601 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -61.49 -36.78 81.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.284 0.564 . . . . 0.0 110.172 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.93 -46.4 37.18 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.018 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 31.4 mm -64.25 -28.15 44.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.423 0.689 . . . . 0.0 111.521 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -55.55 -39.37 70.53 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 122.887 0.475 . . . . 0.0 110.626 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -65.35 -40.98 94.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 43.1 t -63.4 -42.63 96.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.553 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.1 -46.31 96.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 38.9 m -61.59 -42.18 98.5 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.71 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -64.39 -43.41 94.52 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.5 tp . . . . . 0 C--O 1.242 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 110.537 177.779 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.63 0 CA-C-O 121.313 0.577 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 399' ' ' LEU . . . . . 0.545 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.0 mp -95.05 132.62 39.74 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.857 -172.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.09 118.83 15.45 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.87 -52.72 2.77 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -172.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.492 ' HB2' HG21 ' A' ' 441' ' ' THR . 65.2 t90 -154.57 149.89 27.15 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.266 -171.722 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 22.8 t -131.81 130.05 41.28 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.461 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -162.33 -172.79 30.22 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -177.388 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.1 t -113.22 139.29 39.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 426' ' ' SER . 72.8 mt -113.92 140.96 47.95 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.64 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 58.5 mt-10 -115.37 126.28 54.23 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.833 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 58.6 p-90 . . . . . 0 C--N 1.297 -1.701 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -173.539 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 425' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 16.2 mmm180 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.64 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 33.8 p -141.86 138.44 32.13 Favored 'General case' 0 N--CA 1.414 -2.254 0 O-C-N 123.459 0.475 . . . . 0.0 110.495 -175.263 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 96.8 mt -137.25 118.15 10.78 Favored Pre-proline 0 C--N 1.293 -1.883 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.695 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.27 138.62 56.55 Favored 'Trans proline' 0 C--O 1.249 1.056 0 C-N-CA 122.7 2.267 . . . . 0.0 109.542 170.178 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 429' ' ' CYS . . . . . 0.506 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 12.5 p -144.98 165.42 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -175.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -116.45 133.25 56.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.9 t -121.45 124.16 71.22 Favored 'Isoleucine or valine' 0 C--O 1.259 1.564 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.459 -174.383 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -105.25 160.81 14.81 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 175.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 471' ' ' VAL . 15.5 m -121.97 140.57 45.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 175.581 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.538 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 27.1 t-20 -96.16 132.18 41.85 Favored 'General case' 1 C--O 1.316 4.565 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.28 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.545 ' CD2' HD11 ' A' ' 399' ' ' LEU . 77.0 m-70 -33.0 160.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 O-C-N 128.305 3.503 . . . . 0.0 116.438 -170.372 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.74 -1.27 30.44 Favored Glycine 0 CA--C 1.497 -1.06 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.48 161.66 13.49 Favored 'General case' 0 C--N 1.289 -2.039 0 C-N-CA 126.194 1.798 . . . . 0.0 115.121 -172.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -159.36 98.88 1.44 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 168.418 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 439' ' ' LEU . . . . . 0.403 HD12 ' CZ2' ' A' ' 444' ' ' TRP . 1.9 pt? -139.19 139.38 37.5 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.732 -0.605 . . . . 0.0 112.163 -175.506 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -103.07 106.6 17.15 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 402' ' ' TRP . 25.2 p -80.28 -2.79 46.67 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 122.215 1.007 . . . . 0.0 112.435 -175.337 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.13 -14.22 60.94 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.225 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -101.45 9.61 41.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.782 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' TRP . . . . . 0.403 ' CZ2' HD12 ' A' ' 439' ' ' LEU . 33.7 m0 -99.08 140.64 21.85 Favored Pre-proline 0 C--O 1.247 0.945 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.368 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.64 153.99 64.54 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.877 1.718 . . . . 0.0 109.816 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -81.0 -5.16 57.25 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 92.3 mttt -132.21 126.21 33.0 Favored 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.341 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 448' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 500' ' ' PHE . 73.5 mt -118.6 146.99 44.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 63.4 mt -105.02 125.97 59.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.501 -177.433 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.408 ' HB2' HG22 ' A' ' 498' ' ' VAL . 48.5 ttp -106.79 118.02 35.58 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.426 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -99.86 127.04 46.06 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 175.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 452' ' ' LEU . . . . . 0.55 HD13 HG21 ' A' ' 489' ' ' ILE . 29.6 mt -86.67 136.79 32.9 Favored 'General case' 0 C--N 1.28 -2.413 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.31 161.27 60.14 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.83 129.09 16.92 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.348 1.366 . . . . 0.0 111.234 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.37 -25.13 68.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.916 0.886 . . . . 0.0 111.77 -177.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -58.76 -37.04 75.37 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 120.851 0.358 . . . . 0.0 110.976 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 7.7 mp -83.3 3.21 32.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.298 0.57 . . . . 0.0 111.42 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.95 -16.45 61.53 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.882 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 18.8 p -58.74 -30.62 67.62 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.854 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 7.5 m -71.27 -18.81 62.41 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.538 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.02 5.28 38.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 122.106 -0.371 . . . . 0.0 111.806 -175.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.3 -55.44 3.04 Favored Glycine 0 CA--C 1.559 2.781 0 CA-C-N 114.854 -1.067 . . . . 0.0 115.304 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.23 -26.43 76.5 Favored 'Trans proline' 0 C--N 1.368 1.588 0 C-N-CA 123.405 2.737 . . . . 0.0 114.011 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.77 -46.12 66.51 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -72.64 -14.72 61.66 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.215 -178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -70.47 -24.77 62.92 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.357 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -122.2 85.04 2.35 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' SER . . . . . 0.439 ' HB2' HD23 ' A' ' 525' ' ' LEU . 53.2 m -151.73 163.04 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.639 0.733 . . . . 0.0 112.657 -175.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.37 142.91 41.4 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 126.28 1.832 . . . . 0.0 106.458 177.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.538 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 1.9 mmm -96.66 151.33 19.73 Favored 'General case' 0 CA--C 1.487 -1.447 0 C-N-CA 118.439 -1.305 . . . . 0.0 110.976 -168.207 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 433' ' ' VAL . 35.9 m -135.21 154.34 35.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 C-N-CA 123.695 0.798 . . . . 0.0 109.239 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -134.14 123.64 24.74 Favored 'General case' 0 C--N 1.285 -2.215 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.455 ' CE2' HD11 ' A' ' 406' ' ' LEU . 25.6 m-85 -107.91 133.4 52.3 Favored 'General case' 0 C--O 1.278 2.564 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.901 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -131.03 123.63 29.13 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 172.002 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' PHE . . . . . 0.506 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 98.4 m-85 . . . . . 0 C--N 1.305 -1.356 0 O-C-N 123.091 0.244 . . . . 0.0 110.545 -177.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -69.52 -36.94 76.88 Favored 'General case' 0 C--N 1.31 -1.138 0 O-C-N 122.963 0.164 . . . . 0.0 111.248 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 66.6 m -67.42 -40.04 85.52 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.632 174.331 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' LEU . . . . . 0.411 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 3.7 mm? -63.76 -45.93 87.59 Favored 'General case' 0 C--O 1.206 -1.214 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.739 176.62 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -55.21 -45.68 75.91 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.811 0.444 . . . . 0.0 110.611 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.414 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.44 -44.23 74.38 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.033 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -63.72 -43.81 95.45 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.438 0.695 . . . . 0.0 109.883 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 10.3 m-85 -56.91 -42.52 80.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.961 0.504 . . . . 0.0 111.053 177.281 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 488' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 492' ' ' ASN . 55.5 mtp180 -67.26 -44.57 79.05 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.816 178.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.55 HG21 HD13 ' A' ' 452' ' ' LEU . 75.4 mt -61.04 -48.18 90.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 O-C-N 123.396 0.435 . . . . 0.0 110.688 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 20.7 mmt -63.64 -46.63 84.78 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -68.5 -20.61 73.87 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.408 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 488' ' ' ARG . 4.0 t30 -80.78 0.24 35.65 Favored 'General case' 0 C--O 1.245 0.866 0 CA-C-O 121.551 0.691 . . . . 0.0 110.197 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.99 31.09 6.4 Favored Glycine 0 N--CA 1.439 -1.128 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.384 177.592 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -109.88 162.22 14.7 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 122.36 -0.494 . . . . 0.0 110.396 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -135.93 150.17 49.2 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -111.63 111.72 2.97 Favored Glycine 0 N--CA 1.43 -1.731 0 C-N-CA 119.482 -1.342 . . . . 0.0 113.031 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.06 115.55 22.94 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 176.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' VAL . . . . . 0.408 HG22 ' HB2' ' A' ' 450' ' ' MET . 47.6 t -101.48 120.85 51.65 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 CA-C-O 121.575 0.702 . . . . 0.0 109.535 -175.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -111.5 139.82 46.61 Favored 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.086 -1.416 . . . . 0.0 110.508 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' PHE . . . . . 0.411 ' HA ' HD22 ' A' ' 448' ' ' LEU . 2.4 m-85 -102.21 133.43 20.62 Favored Pre-proline 0 C--N 1.292 -1.894 0 CA-C-N 113.915 -1.493 . . . . 0.0 108.761 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo . . . . . 0 C--O 1.255 1.345 0 N-CA-C 107.815 -1.648 . . . . 0.0 107.815 167.012 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.241 0.611 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 31.8 mtt180 73.42 169.07 0.31 Allowed 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.249 1.42 . . . . 0.0 109.614 175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.544 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 16.0 m -131.1 163.91 35.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.903 -174.411 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.505 ' HB3' HG12 ' A' ' 526' ' ' ILE . 3.3 pp -138.33 154.96 48.98 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 118.068 -1.453 . . . . 0.0 110.541 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 41.3 ttm -117.25 130.1 56.34 Favored 'General case' 0 C--N 1.295 -1.772 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.534 173.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 522' ' ' PHE . 34.9 tp -95.63 129.78 42.72 Favored 'General case' 0 N--CA 1.411 -2.404 0 O-C-N 124.018 0.824 . . . . 0.0 108.991 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 64.4 mt -133.02 148.84 52.23 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.326 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -100.05 121.9 42.09 Favored 'General case' 0 C--N 1.271 -2.822 0 O-C-N 122.233 -0.292 . . . . 0.0 110.477 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 37.9 t -95.23 109.43 21.54 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.0 m -68.81 -35.41 76.96 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.733 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -69.6 -31.34 69.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.276 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -97.59 -9.99 25.97 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.842 0.353 . . . . 0.0 110.4 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 59.57 35.89 22.68 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 124.35 1.06 . . . . 0.0 111.413 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -143.01 167.5 14.07 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB3' HD11 ' A' ' 513' ' ' LEU . 52.5 m-85 -98.83 138.57 35.78 Favored 'General case' 0 N--CA 1.413 -2.305 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.901 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.4 ptm -127.06 165.88 18.65 Favored 'General case' 0 C--N 1.284 -2.274 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.19 150.88 15.34 Favored Glycine 0 N--CA 1.41 -3.047 0 C-N-CA 119.054 -1.546 . . . . 0.0 112.055 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.479 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.8 mp -114.29 140.24 48.76 Favored 'General case' 0 C--N 1.273 -2.743 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.505 HG12 ' HB3' ' A' ' 511' ' ' LEU . 7.3 mt -99.24 108.05 47.89 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 123.793 0.683 . . . . 0.0 110.812 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 34.2 Cg_exo -68.69 131.2 22.23 Favored 'Trans proline' 0 C--O 1.295 3.348 0 C-N-CA 122.102 1.868 . . . . 0.0 110.963 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -74.63 -41.57 60.14 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.389 -1.732 . . . . 0.0 110.27 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -73.85 84.89 1.7 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.995 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -66.37 -43.79 84.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.127 -179.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 15.2 m -61.34 -44.0 97.92 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.31 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -68.56 -44.86 70.09 Favored Glycine 0 C--O 1.243 0.713 0 C-N-CA 121.171 -0.537 . . . . 0.0 112.866 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.495 ' CE2' HG13 ' A' ' 537' ' ' ILE . 67.6 t80 -67.4 -48.27 67.85 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 122.126 0.17 . . . . 0.0 111.117 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.2 -37.94 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 O-C-N 123.187 0.304 . . . . 0.0 110.567 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -58.2 -46.91 84.99 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.039 0.447 . . . . 0.0 110.383 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.95 -43.38 49.65 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.706 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 541' ' ' ILE . 32.8 mm -62.03 -36.24 73.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 122.383 0.273 . . . . 0.0 111.56 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -60.65 -35.4 76.1 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.202 0.525 . . . . 0.0 110.672 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.07 -37.71 75.55 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.31 -37.94 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.642 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.55 HG12 ' O ' ' A' ' 537' ' ' ILE . 43.8 mm -60.39 -45.68 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 92.4 m -59.68 -42.93 94.03 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.658 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -67.43 -37.29 82.81 Favored 'General case' 0 C--O 1.203 -1.39 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.558 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 541' ' ' ILE . 51.9 tp . . . . . 0 C--N 1.315 -0.92 0 C-N-CA 124.197 0.999 . . . . 0.0 111.372 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 398' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.328 0 CA-C-O 121.507 0.67 . . . . 0.0 112.375 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 399' ' ' LEU . . . . . 0.475 HD11 ' ND1' ' A' ' 435' ' ' HIS . 3.2 mp -115.25 137.47 52.0 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 171.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.46 121.7 17.51 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.39 -57.08 2.13 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.503 ' HB2' HG21 ' A' ' 441' ' ' THR . 61.2 t90 -153.37 145.36 23.66 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 120.895 0.379 . . . . 0.0 111.188 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 25.0 p -119.72 126.91 52.22 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.313 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.45 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -165.47 -172.23 32.64 Favored Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.328 -176.351 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 59.5 t -113.19 135.54 52.37 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -177.474 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 448' ' ' LEU . 15.7 tp -113.94 136.81 52.48 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.481 ' HG2' ' CB ' ' A' ' 426' ' ' SER . 51.6 mt-10 -114.54 133.87 55.46 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 51.1 p-90 . . . . . 0 C--N 1.295 -1.781 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.352 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 42.4 mmt180 . . . . . 0 N--CA 1.411 -2.405 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.481 ' CB ' ' HG2' ' A' ' 407' ' ' GLU . 1.0 OUTLIER -137.85 130.14 29.17 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -177.315 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 90.3 mt -131.47 126.73 21.34 Favored Pre-proline 0 C--N 1.294 -1.809 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -60.23 138.71 83.06 Favored 'Trans proline' 0 C--O 1.249 1.03 0 C-N-CA 122.286 1.991 . . . . 0.0 110.742 172.358 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.6 p -145.95 157.4 43.89 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.038 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -117.36 129.37 55.83 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 46.5 t -113.67 124.2 70.08 Favored 'Isoleucine or valine' 0 C--O 1.257 1.469 0 CA-C-O 121.732 0.777 . . . . 0.0 111.129 -173.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.54 161.34 15.15 Favored 'General case' 0 C--N 1.28 -2.415 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.321 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 471' ' ' VAL . 6.1 m -119.79 140.71 42.92 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 174.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.633 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 26.8 t-20 -94.06 130.13 40.32 Favored 'General case' 1 C--O 1.339 5.809 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 171.713 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.475 ' ND1' HD11 ' A' ' 399' ' ' LEU . 0.5 OUTLIER -47.53 165.05 0.03 OUTLIER 'General case' 0 C--N 1.357 0.893 0 O-C-N 128.931 3.894 . . . . 0.0 115.372 -162.385 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 436' ' ' GLY . . . . . 0.449 ' H ' ' CD2' ' A' ' 435' ' ' HIS . . . 110.14 -2.98 29.88 Favored Glycine 0 N--CA 1.423 -2.168 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -172.146 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -132.38 159.59 38.79 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.558 -174.403 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -152.57 98.67 2.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 170.728 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 439' ' ' LEU . . . . . 0.542 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -118.82 158.53 25.45 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.947 0.403 . . . . 0.0 111.91 -177.846 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -102.14 118.13 36.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.503 HG21 ' HB2' ' A' ' 402' ' ' TRP . 20.2 p -95.97 8.0 44.85 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.346 1.069 . . . . 0.0 109.626 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.81 -22.84 66.59 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.205 -1.362 . . . . 0.0 111.412 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -107.47 17.27 22.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.036 0.446 . . . . 0.0 111.532 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -91.17 136.03 27.7 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.433 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -64.43 158.75 47.65 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.156 1.904 . . . . 0.0 109.469 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.02 -7.09 59.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.123 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 88.8 mttt -128.5 130.38 47.41 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 122.756 0.422 . . . . 0.0 110.59 176.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 448' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 406' ' ' LEU . 83.8 mt -119.16 147.27 44.38 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 43.9 mm -99.22 120.54 48.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.462 ' SD ' HD23 ' A' ' 513' ' ' LEU . 56.2 ttp -111.96 119.28 37.96 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.067 0.46 . . . . 0.0 111.333 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -104.9 133.16 50.17 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.02 122.09 29.56 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 120.969 0.414 . . . . 0.0 111.0 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 pt -129.77 157.81 75.58 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.676 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.41 129.34 29.3 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 121.832 1.688 . . . . 0.0 113.134 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -63.74 -25.46 68.21 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.197 0.999 . . . . 0.0 111.57 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -57.62 -41.49 81.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.584 0.753 . . . . 0.0 111.742 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.04 5.58 21.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.133 -172.259 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.97 -27.21 36.09 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.599 -178.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -31.43 67.08 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -174.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.7 m -72.46 -17.85 61.73 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.364 0.666 . . . . 0.0 112.439 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 10.8 tp -85.6 11.12 11.41 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.304 0.642 . . . . 0.0 111.318 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -37.6 -54.54 1.77 Allowed Glycine 0 CA--C 1.545 1.966 0 N-CA-C 116.667 1.427 . . . . 0.0 116.667 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.21 -40.67 51.54 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 123.07 2.513 . . . . 0.0 113.424 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.76 -30.45 70.67 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.201 0.524 . . . . 0.0 111.355 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -78.07 -13.11 59.99 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.444 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -74.78 -43.33 55.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.621 175.81 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' ASN . . . . . 0.401 ' O ' ' HA ' ' A' ' 527' ' ' PRO . 9.8 p-10 -95.54 74.2 3.24 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 122.025 0.917 . . . . 0.0 110.057 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -142.32 169.85 16.81 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.95 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.542 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 14.3 ptp180 -139.63 143.79 37.37 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 127.529 2.332 . . . . 0.0 105.724 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.633 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 62.1 mtp -97.23 153.12 18.22 Favored 'General case' 0 CA--C 1.483 -1.599 0 C-N-CA 115.982 -2.287 . . . . 0.0 111.875 -167.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 433' ' ' VAL . 34.8 m -133.03 159.76 42.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.993 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -134.28 121.39 21.21 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 14.1 m-85 -107.3 117.65 34.65 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.198 -177.27 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -111.87 122.27 47.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 C--N 1.303 -1.456 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.532 -176.08 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -69.91 -41.5 74.58 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 120.809 0.337 . . . . 0.0 111.211 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 35.7 m -63.67 -35.31 80.12 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.749 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 93.5 mt -73.03 -51.41 18.26 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.04 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -55.33 -36.77 66.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.193 0.597 . . . . 0.0 111.628 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -60.51 -50.83 63.26 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.02 -42.8 89.15 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 123.251 0.62 . . . . 0.0 110.772 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -58.26 -45.51 87.69 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.18 0.592 . . . . 0.0 110.295 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -65.41 -38.57 90.35 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.391 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 485' ' ' GLY . 80.4 mt -68.21 -50.38 58.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.988 0.423 . . . . 0.0 110.572 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 490' ' ' MET . . . . . 0.488 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 91.8 mtp -70.72 -35.79 72.89 Favored 'General case' 0 C--N 1.312 -1.039 0 O-C-N 122.134 -0.354 . . . . 0.0 111.592 -176.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.76 -18.66 70.56 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -81.92 6.84 14.61 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.869 0.842 . . . . 0.0 110.107 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.35 29.73 6.94 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.529 -0.843 . . . . 0.0 113.015 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -112.45 158.67 19.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -129.28 160.14 33.92 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -115.1 115.81 3.55 Favored Glycine 0 N--CA 1.417 -2.599 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.6 t -92.74 118.89 31.55 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 498' ' ' VAL . . . . . 0.446 HG22 ' HB2' ' A' ' 450' ' ' MET . 78.0 t -101.66 120.78 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 CA-C-O 121.361 0.6 . . . . 0.0 110.151 -178.022 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 499' ' ' HIS . . . . . 0.505 ' NE2' HG22 ' A' ' 534' ' ' VAL . 27.1 m80 -109.36 140.46 43.02 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.41 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -104.06 125.89 33.21 Favored Pre-proline 0 C--N 1.292 -1.934 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.535 -175.339 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo . . . . . 0 N--CA 1.459 -0.501 0 C-N-CA 121.902 1.735 . . . . 0.0 108.351 172.168 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.437 -1.099 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 20.4 mtm-85 72.82 177.08 0.26 Allowed 'General case' 0 C--N 1.371 1.51 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.274 177.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 5.6 m -133.83 162.33 39.58 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.664 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 526' ' ' ILE . 0.9 OUTLIER -134.19 136.52 43.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.08 0.854 . . . . 0.0 113.172 -171.429 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 512' ' ' MET . . . . . 0.454 ' N ' HD22 ' A' ' 511' ' ' LEU . 49.1 tpp -101.83 118.83 37.74 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.239 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 522' ' ' PHE . 24.2 tp -105.14 126.62 52.28 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.531 0.681 . . . . 0.0 110.183 -177.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 79.6 mt -123.97 135.04 53.38 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.184 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -89.61 123.44 33.68 Favored 'General case' 0 C--N 1.285 -2.212 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.335 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.3 t -98.72 110.19 22.83 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 31.7 m -68.33 -27.25 66.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.494 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.17 -44.13 96.29 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.422 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -103.79 1.09 31.2 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.821 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . 0.421 0.0 OUTLIER 49.15 34.92 6.44 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.11 2.164 . . . . 0.0 114.421 -176.352 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -137.62 167.83 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.802 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.095 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 70.0 m-85 -98.19 136.79 37.9 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.233 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -119.56 145.91 45.96 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -156.23 154.12 25.27 Favored Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 118.285 -1.912 . . . . 0.0 113.516 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.516 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 10.6 mp -115.37 135.02 54.56 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 171.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.53 HG12 HD23 ' A' ' 511' ' ' LEU . 16.5 mt -101.36 107.45 50.84 Favored Pre-proline 0 N--CA 1.439 -0.983 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.568 ' HG2' ' CD2' ' A' ' 533' ' ' PHE . 35.9 Cg_exo -72.19 138.46 30.62 Favored 'Trans proline' 0 C--O 1.292 3.179 0 C-N-CA 122.994 2.463 . . . . 0.0 111.944 170.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -77.07 -43.07 35.74 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.302 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.41 92.25 4.57 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.64 0.734 . . . . 0.0 110.156 -176.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . 0.253 0.0 OUTLIER -67.21 -31.08 71.21 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 114.959 -1.018 . . . . 0.0 113.569 -179.367 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.3 m -62.83 -47.55 82.9 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -176.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.98 -34.69 52.07 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.229 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.568 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 49.9 t80 -68.36 -48.08 65.73 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 534' ' ' VAL . . . . . 0.505 HG22 ' NE2' ' A' ' 499' ' ' HIS . 95.2 t -64.44 -39.12 84.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 O-C-N 123.181 0.3 . . . . 0.0 110.508 -178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -67.12 -40.38 86.8 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 109.762 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -64.09 -46.53 90.96 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.532 ' O ' HG13 ' A' ' 541' ' ' ILE . 43.7 mm -64.01 -37.38 79.65 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 C-N-CA 122.247 0.219 . . . . 0.0 110.799 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -57.87 -39.67 78.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 110.119 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' GLN . . . . . 0.528 ' HA ' HG22 ' A' ' 542' ' ' THR . 49.0 mt-30 -67.66 -34.09 76.23 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 91.1 t -67.41 -48.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.748 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 537' ' ' ILE . 62.2 mt -60.97 -44.88 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 542' ' ' THR . . . . . 0.528 HG22 ' HA ' ' A' ' 539' ' ' GLN . 1.9 t -67.86 -33.55 74.97 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.822 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.25 -42.55 88.42 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 123.577 0.751 . . . . 0.0 110.664 178.964 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.425 -1.712 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 399' ' ' LEU . . . . . 0.424 ' HB2' HG23 ' A' ' 433' ' ' VAL . 3.2 mp -108.68 136.29 48.51 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 64.1 tp -70.1 118.83 13.43 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.19 -51.24 2.86 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.499 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 78.4 t90 -155.19 149.21 25.72 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.459 -172.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 13.1 p -130.61 117.63 19.81 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 176.695 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.499 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -159.54 -172.53 26.83 Favored Glycine 0 N--CA 1.433 -1.562 0 C-N-CA 119.795 -1.193 . . . . 0.0 112.589 -175.794 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -112.03 136.69 47.43 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-O 121.099 0.476 . . . . 0.0 109.876 -176.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.526 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.4 mp -113.19 139.08 49.07 Favored 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.491 ' HG3' ' HB3' ' A' ' 426' ' ' SER . 30.2 tt0 -116.22 126.83 54.16 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -178.411 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 408' ' ' TRP . . . . . 0.456 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 19.3 p-90 . . . . . 0 C--N 1.302 -1.491 0 CA-C-O 121.46 0.647 . . . . 0.0 112.584 -175.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.416 -2.164 0 CA-C-O 121.056 0.455 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 407' ' ' GLU . 51.4 p -142.2 138.55 31.57 Favored 'General case' 0 N--CA 1.409 -2.506 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 81.1 mt -135.41 135.77 23.0 Favored Pre-proline 0 C--N 1.307 -1.242 0 O-C-N 122.852 0.095 . . . . 0.0 110.861 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.45 135.93 20.9 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.573 2.182 . . . . 0.0 112.043 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 429' ' ' CYS . . . . . 0.526 ' SG ' HD13 ' A' ' 406' ' ' LEU . 20.3 p -142.29 167.13 22.84 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.493 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -115.79 129.88 56.62 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 45.3 t -114.05 123.98 70.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.719 0 CA-C-O 122.143 0.973 . . . . 0.0 110.792 -175.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -113.47 160.42 18.48 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 114.035 -1.439 . . . . 0.0 107.39 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 471' ' ' VAL . 15.4 m -122.75 141.77 41.87 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 CA-C-O 120.694 0.283 . . . . 0.0 111.6 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 470' ' ' MET . 3.0 m120 -94.59 132.16 39.59 Favored 'General case' 1 C--O 1.314 4.448 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 168.529 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 43.6 m80 -39.26 165.72 0.0 OUTLIER 'General case' 0 C--N 1.37 1.463 0 O-C-N 127.387 2.929 . . . . 0.0 116.197 -168.83 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.33 -2.39 31.1 Favored Glycine 0 CA--C 1.502 -0.766 0 N-CA-C 109.096 -1.601 . . . . 0.0 109.096 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.409 ' CB ' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -106.63 161.91 14.22 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.05 -1.075 . . . . 0.0 113.118 -174.439 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -160.88 94.49 1.03 Allowed 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 439' ' ' LEU . . . . . 0.512 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 2.3 pt? -141.92 151.22 42.41 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.252 178.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -102.47 135.49 44.0 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.432 HG21 ' HB2' ' A' ' 402' ' ' TRP . 14.0 p -94.6 23.15 5.54 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -171.785 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -75.55 -28.33 58.97 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.255 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -72.07 -15.52 62.01 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.208 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -88.24 126.84 59.32 Favored Pre-proline 0 C--N 1.311 -1.07 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.455 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 445' ' ' PRO . . . . . 0.435 ' HG2' ' HD2' ' A' ' 501' ' ' PRO . 23.5 Cg_exo -69.84 157.88 58.73 Favored 'Trans proline' 0 C--O 1.224 -0.223 0 C-N-CA 122.186 1.924 . . . . 0.0 110.05 173.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -77.35 -5.98 51.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.128 0.489 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -119.9 124.94 47.27 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 448' ' ' LEU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 406' ' ' LEU . 53.2 mt -118.17 146.69 44.01 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 71.8 mt -101.93 117.79 47.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.887 -176.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.456 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 23.3 ptm -112.82 128.96 56.58 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 121.586 0.708 . . . . 0.0 110.067 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -114.76 130.75 56.89 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.99 124.63 29.31 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.498 0.666 . . . . 0.0 111.503 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.6 pt -133.82 161.42 63.84 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.395 1.078 . . . . 0.0 108.814 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -65.64 128.98 21.18 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 121.385 1.39 . . . . 0.0 111.406 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -63.86 -26.61 68.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.586 0.754 . . . . 0.0 110.388 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.27 -33.02 67.19 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.335 1.054 . . . . 0.0 112.7 -174.067 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 540' ' ' VAL . 90.8 mt -87.06 8.79 22.03 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 39.0 tp -69.73 -22.68 63.36 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.303 0.573 . . . . 0.0 110.483 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 5.1 m -65.62 -29.52 70.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.671 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 9.9 m -72.04 -20.39 61.69 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.757 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 83.1 mt -96.03 10.33 37.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.599 -175.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.22 -51.5 8.99 Favored Glycine 0 CA--C 1.553 2.462 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.1 -19.5 66.6 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.893 2.395 . . . . 0.0 113.94 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -80.16 -42.36 23.57 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -71.68 -13.66 61.8 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.583 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -53.86 -31.79 50.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.14 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -138.13 97.84 3.49 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.9 m -150.4 170.21 19.59 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.292 0.568 . . . . 0.0 111.553 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.512 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 97.3 mtt180 -112.52 142.51 45.0 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.669 ' HB2' ' HB2' ' A' ' 434' ' ' ASN . 61.5 mtp -98.78 151.96 20.22 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 116.944 -1.903 . . . . 0.0 111.242 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 433' ' ' VAL . 26.4 m -135.09 155.39 37.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.891 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -127.76 129.76 47.59 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 25.0 m-85 -112.88 117.98 33.63 Favored 'General case' 0 C--N 1.282 -2.326 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.847 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -121.31 123.73 42.88 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 57.8 m-85 . . . . . 0 C--N 1.296 -1.722 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.624 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 N--CA 1.448 -0.55 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -70.5 -36.55 73.86 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.944 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 38.7 m -65.09 -38.0 89.34 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.13 -41.86 89.91 Favored 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.007 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -54.41 -41.26 69.11 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.037 0.535 . . . . 0.0 111.6 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.488 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -63.15 -46.51 93.05 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.708 178.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.0 tp -66.7 -41.59 87.77 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.73 0.412 . . . . 0.0 110.737 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -61.16 -38.89 88.09 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.237 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -66.39 -46.0 78.13 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 485' ' ' GLY . 67.6 mt -62.55 -51.15 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 490' ' ' MET . . . . . 0.487 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 85.3 mtp -73.46 -36.19 65.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.117 0.484 . . . . 0.0 111.558 -176.261 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.34 71.03 Favored Glycine 0 C--O 1.219 -0.804 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.602 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.5 4.97 25.62 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.036 0.934 . . . . 0.0 110.611 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.57 29.52 6.96 Favored Glycine 0 C--N 1.316 -0.581 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.042 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -112.61 147.38 36.82 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 174.141 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -118.61 159.98 22.62 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.05 115.87 3.19 Favored Glycine 0 N--CA 1.421 -2.327 0 C-N-CA 120.189 -1.005 . . . . 0.0 110.721 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' CYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.1 t -88.32 128.3 35.49 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 75.6 t -100.99 120.57 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-O 121.664 0.745 . . . . 0.0 109.3 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -113.42 134.66 54.53 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -84.12 132.24 48.58 Favored Pre-proline 0 C--N 1.289 -2.061 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.035 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' A' ' 445' ' ' PRO . 31.4 Cg_exo . . . . . 0 N--CA 1.493 1.49 0 C-N-CA 123.595 2.863 . . . . 0.0 114.72 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.0 t . . . . . 0 C--O 1.243 0.72 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 75.14 -178.67 0.16 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.395 1.478 . . . . 0.0 109.754 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.7 m -138.14 162.83 30.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.854 -0.739 . . . . 0.0 109.855 176.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.57 HD13 ' HB ' ' A' ' 526' ' ' ILE . 17.7 tp -135.01 150.04 50.26 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -170.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 40.2 tpp -108.93 140.78 41.95 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.529 HD11 ' HB3' ' A' ' 522' ' ' PHE . 52.7 tp -125.57 122.89 37.81 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.244 0.545 . . . . 0.0 109.952 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 73.3 mt -126.98 139.31 53.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.114 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -93.83 124.55 37.9 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.559 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 16.9 m -106.7 110.58 22.8 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 176.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 18.5 m -68.57 -35.68 77.71 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.834 -1.075 . . . . 0.0 113.218 -174.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -77.3 -29.41 53.69 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 121.449 0.643 . . . . 0.0 110.113 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -87.32 -10.62 51.78 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.89 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 58.24 27.41 15.13 Favored 'General case' 0 C--N 1.345 0.371 0 C-N-CA 124.876 1.27 . . . . 0.0 111.709 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.33 166.58 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.568 0 CA-C-O 121.232 0.539 . . . . 0.0 111.688 -176.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 42.5 m-85 -98.49 138.57 35.52 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.005 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 58.3 ttp -133.35 143.08 48.74 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' GLY . . . . . 0.429 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -151.89 158.94 28.05 Favored Glycine 0 N--CA 1.414 -2.77 0 C-N-CA 119.253 -1.451 . . . . 0.0 112.475 -178.783 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.479 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 10.3 mp -115.3 139.45 49.96 Favored 'General case' 0 C--N 1.291 -1.94 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.638 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.57 ' HB ' HD13 ' A' ' 511' ' ' LEU . 4.9 tt -107.05 108.32 61.81 Favored Pre-proline 0 C--O 1.254 1.324 0 CA-C-O 120.941 0.4 . . . . 0.0 111.65 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.516 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.2 Cg_exo -72.12 138.66 31.17 Favored 'Trans proline' 0 C--O 1.294 3.294 0 C-N-CA 123.433 2.755 . . . . 0.0 113.066 172.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -71.3 -45.32 63.34 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 113.114 -1.857 . . . . 0.0 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.02 104.69 13.41 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.364 0.602 . . . . 0.0 111.166 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -36.07 81.12 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.626 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 80.3 p -63.71 -47.66 80.22 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -72.1 -38.74 59.32 Favored Glycine 0 N--CA 1.434 -1.477 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.432 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.497 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 44.9 t80 -71.05 -47.36 58.94 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.245 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.55 -38.53 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.318 0.58 . . . . 0.0 109.61 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -59.59 -41.47 90.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.809 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -67.85 -41.81 87.58 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.176 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.497 ' O ' HG13 ' A' ' 541' ' ' ILE . 47.6 mm -61.55 -36.7 74.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 122.492 0.317 . . . . 0.0 110.433 177.534 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -56.39 -38.69 71.82 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.863 0.363 . . . . 0.0 110.525 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.3 -41.8 84.79 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 457' ' ' LEU . 54.4 t -63.28 -43.87 98.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.118 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 541' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 537' ' ' ILE . 71.9 mt -59.98 -44.58 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.464 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 83.4 m -62.84 -38.94 92.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.741 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -67.55 -38.21 83.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.087 0.47 . . . . 0.0 110.026 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.988 178.061 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 63.6 mttp . . . . . 0 N--CA 1.427 -1.584 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -90.33 122.49 33.27 Favored 'General case' 0 C--N 1.284 -2.256 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.096 -175.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 60.0 tp -62.36 116.35 4.98 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 175.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.29 -52.92 2.26 Favored 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.54 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 51.4 t90 -146.34 133.66 20.65 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 118.85 -1.14 . . . . 0.0 112.71 -170.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 38.5 t -111.2 119.94 40.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.54 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.08 -173.46 26.53 Favored Glycine 0 N--CA 1.426 -1.974 0 C-N-CA 119.411 -1.376 . . . . 0.0 112.43 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.2 142.44 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.048 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 406' ' ' LEU . . . . . 0.427 HD11 ' CE1' ' A' ' 473' ' ' PHE . 88.9 mt -112.67 138.49 49.39 Favored 'General case' 0 C--N 1.293 -1.868 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 407' ' ' GLU . . . . . 0.525 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 26.3 mt-10 -115.67 125.73 53.23 Favored 'General case' 0 N--CA 1.402 -2.858 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.979 175.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 . . . . . 0 C--N 1.285 -2.227 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.374 -175.365 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 425' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 31.0 mmt180 . . . . . 0 CA--C 1.505 -0.777 0 CA-C-O 120.479 0.18 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 2.9 p -110.84 139.94 45.72 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -173.139 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 427' ' ' LEU . . . . . 0.526 HD13 HD23 ' A' ' 483' ' ' LEU . 77.2 mt -137.12 125.09 14.5 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.985 175.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.23 146.62 32.07 Favored 'Trans proline' 0 C--O 1.248 0.979 0 C-N-CA 122.707 2.271 . . . . 0.0 111.605 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 21.7 p -147.49 167.46 24.4 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.817 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -116.48 129.89 56.46 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 41.4 t -124.87 123.85 66.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.923 0 CA-C-O 121.988 0.899 . . . . 0.0 112.18 -175.762 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -109.13 158.6 17.63 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 27.8 m -121.77 139.82 47.66 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.994 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.795 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 48.6 t30 -95.72 131.83 41.57 Favored 'General case' 1 C--O 1.308 4.158 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 174.202 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.523 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 51.8 m80 -37.41 153.19 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 O-C-N 127.773 3.171 . . . . 0.0 116.448 -167.768 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.54 -2.42 30.77 Favored Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.929 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 437' ' ' GLU . . . . . 0.523 ' OE1' ' HA ' ' A' ' 435' ' ' HIS . 1.0 OUTLIER -82.36 161.08 22.66 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 124.281 1.032 . . . . 0.0 112.638 -173.712 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -146.02 96.05 2.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.618 167.031 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 439' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 441' ' ' THR . 0.0 OUTLIER -140.34 141.37 35.67 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.088 175.175 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -104.06 106.85 17.5 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 105.107 -2.183 . . . . 0.0 105.107 166.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.565 HG23 HD23 ' A' ' 439' ' ' LEU . 8.1 p -70.13 -12.68 61.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.021 0.915 . . . . 0.0 112.588 -175.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -68.49 -22.75 64.53 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.63 174.128 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -103.58 12.52 34.88 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 122.305 1.05 . . . . 0.0 108.982 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 444' ' ' TRP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 445' ' ' PRO . 9.9 m0 -93.57 140.55 23.16 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 445' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 444' ' ' TRP . 16.9 Cg_exo -70.89 144.83 49.05 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 122.042 1.828 . . . . 0.0 109.045 171.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -81.35 -5.25 57.65 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.918 0.39 . . . . 0.0 111.183 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -128.25 120.19 26.66 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.994 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.33 147.18 41.82 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.9 mm -99.23 123.2 51.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.815 0.34 . . . . 0.0 110.207 -175.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.26 135.41 53.87 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.109 0.48 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 451' ' ' GLN . . . . . 0.581 ' HB3' ' SG ' ' A' ' 497' ' ' CYS . 54.0 tp60 -117.83 131.13 56.6 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.94 125.07 33.8 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.9 pt -134.2 159.86 70.73 Favored Pre-proline 0 C--N 1.317 -0.839 0 C-N-CA 123.218 0.607 . . . . 0.0 110.16 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -64.11 129.31 23.98 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 121.861 1.707 . . . . 0.0 112.1 176.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -63.55 -29.52 70.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.676 0.79 . . . . 0.0 111.386 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -57.75 -41.2 81.41 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.132 0.491 . . . . 0.0 111.93 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.403 HD12 HG13 ' A' ' 540' ' ' VAL . 73.8 mt -76.16 -8.73 57.69 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.568 -173.781 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 51.1 tp -70.15 -16.79 63.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.582 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.5 t -60.5 -25.18 65.89 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-O 121.026 0.441 . . . . 0.0 111.316 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 5.3 m -71.31 -19.33 62.33 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.438 0.695 . . . . 0.0 110.652 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.0 4.27 52.78 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.999 0.428 . . . . 0.0 111.443 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.32 -54.23 3.28 Favored Glycine 0 CA--C 1.548 2.129 0 CA-C-N 114.319 -1.31 . . . . 0.0 115.583 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.5 -20.84 51.26 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 122.914 2.409 . . . . 0.0 114.723 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.72 -36.96 59.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.835 -0.54 . . . . 0.0 110.884 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -68.97 -13.21 62.31 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.865 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.61 -36.13 79.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.85 89.02 3.03 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 109.592 175.463 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 525' ' ' LEU . 49.3 m -144.14 160.17 41.38 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.342 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -111.23 141.93 44.1 Favored 'General case' 0 C--N 1.284 -2.269 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.795 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 72.4 mtp -98.39 153.01 18.88 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 118.036 -1.466 . . . . 0.0 112.159 -170.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 22.1 m -134.18 162.15 39.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.596 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -133.29 123.08 24.84 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 173.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 17.2 m-85 -107.72 134.39 50.76 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.898 0.749 . . . . 0.0 110.068 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -133.93 123.51 24.81 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 172.6 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 . . . . . 0 C--N 1.289 -2.03 0 C-N-CA 121.204 -0.198 . . . . 0.0 110.761 -178.19 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -70.64 -41.7 71.82 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 9.3 t -67.75 -43.07 80.74 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' LEU . . . . . 0.526 HD23 HD13 ' A' ' 427' ' ' LEU . 83.8 mt -64.69 -30.16 71.17 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.84 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 88.0 tttt -54.99 -47.27 74.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.115 0.566 . . . . 0.0 110.817 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -64.38 -42.04 97.85 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.957 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.8 tt -65.03 -45.05 87.06 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -60.31 -40.3 90.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.285 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 488' ' ' ARG . . . . . 0.562 ' HA ' ' CZ ' ' A' ' 488' ' ' ARG . 2.6 mmp_? -62.92 -50.28 71.46 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.714 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 76.3 mt -57.71 -45.47 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 122.703 0.401 . . . . 0.0 110.649 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 19.0 mmt -63.92 -43.87 94.59 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.312 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.93 -22.59 74.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.337 -0.392 . . . . 0.0 112.335 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -76.76 -7.02 54.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.822 0.449 . . . . 0.0 111.641 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.4 30.4 6.96 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 119.373 -1.394 . . . . 0.0 112.482 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.73 162.24 13.7 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -125.18 158.35 34.19 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -117.41 108.24 1.67 Allowed Glycine 0 N--CA 1.426 -1.988 0 C-N-CA 120.3 -0.952 . . . . 0.0 111.601 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 451' ' ' GLN . 10.6 p -83.87 118.55 24.04 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.4 121.28 55.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.17 136.09 50.74 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.219 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -97.64 133.46 23.54 Favored Pre-proline 0 C--N 1.291 -1.959 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo . . . . . 0 N--CA 1.454 -0.838 0 N-CA-C 107.909 -1.612 . . . . 0.0 107.909 169.117 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 CA--C 1.52 -0.209 0 N-CA-C 107.416 -1.328 . . . . 0.0 107.416 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 509' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 527' ' ' PRO . 11.1 mmt180 -98.06 -166.76 1.42 Allowed 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.091 -168.097 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 22.6 m -121.53 163.07 19.93 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.151 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.944 -177.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.559 ' HB2' HG12 ' A' ' 526' ' ' ILE . 14.4 tp -130.91 145.81 52.13 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -170.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 32.4 tpp -113.42 120.71 41.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.308 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.439 HD11 ' HB3' ' A' ' 522' ' ' PHE . 45.9 tp -105.87 126.8 52.61 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.226 0.536 . . . . 0.0 110.076 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 80.7 mt -132.36 148.75 52.43 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.435 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.25 128.65 52.02 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-O 120.702 0.286 . . . . 0.0 110.773 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 18.8 m -107.86 110.66 22.49 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.5 p -68.18 -35.87 78.71 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 124.43 1.092 . . . . 0.0 113.218 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.86 -33.38 66.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -97.39 -3.65 39.86 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.42 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 520' ' ' LYS . 24.9 tptp 59.67 36.62 22.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.795 1.238 . . . . 0.0 111.298 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -140.66 165.59 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.981 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.044 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 39.7 m-85 -103.39 132.52 49.58 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.0 ptm -110.8 157.6 19.61 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' GLY . . . . . 0.406 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -164.23 143.59 8.69 Favored Glycine 0 N--CA 1.405 -3.418 0 C-N-CA 119.094 -1.527 . . . . 0.0 112.021 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 525' ' ' LEU . . . . . 0.492 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 11.0 mp -114.92 137.74 51.63 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 172.626 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.8 mt -107.11 106.97 59.75 Favored Pre-proline 0 N--CA 1.428 -1.551 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.559 ' O ' ' HB3' ' A' ' 509' ' ' ARG . 29.4 Cg_exo -70.32 134.01 25.82 Favored 'Trans proline' 0 C--O 1.292 3.212 0 C-N-CA 123.186 2.591 . . . . 0.0 112.189 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -76.78 -27.43 55.28 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 113.37 -1.741 . . . . 0.0 112.058 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.04 90.11 7.99 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -66.82 -33.69 76.17 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.926 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.4 p -58.27 -48.32 80.81 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -174.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.76 -34.36 43.69 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.801 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' PHE . . . . . 0.407 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 51.6 t80 -68.52 -47.7 66.27 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 534' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 538' ' ' ARG . 89.6 t -62.65 -40.69 89.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 O-C-N 123.352 0.407 . . . . 0.0 110.22 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -57.64 -45.93 84.82 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' GLY . . . . . 0.447 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -69.18 -44.95 63.7 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.73 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 41.8 mm -63.32 -34.07 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 122.558 0.343 . . . . 0.0 111.754 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 534' ' ' VAL . 56.9 mtp180 -56.17 -46.77 79.22 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.94 -39.94 95.31 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.742 0.651 . . . . 0.0 109.57 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 540' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 536' ' ' GLY . 97.7 t -60.86 -48.09 90.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.553 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 79.5 mt -61.81 -45.47 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.07 0.462 . . . . 0.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 54.3 m -62.06 -40.37 95.55 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.647 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -67.69 -36.77 81.29 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 CA--C 1.542 0.665 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.27 176.586 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.282 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 399' ' ' LEU . . . . . 0.438 ' CD2' ' HB3' ' A' ' 435' ' ' HIS . 2.4 mp -108.84 119.34 39.25 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 67.1 tp -69.02 121.46 16.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -120.67 -46.02 2.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -176.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 402' ' ' TRP . . . . . 0.506 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 41.7 t90 -150.05 149.23 30.03 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.385 -174.182 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 10.3 p -133.66 117.71 17.32 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 173.588 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 404' ' ' GLY . . . . . 0.506 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.75 -172.29 25.67 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.306 -173.218 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 405' ' ' VAL . . . . . 0.536 HG12 ' HB2' ' A' ' 426' ' ' SER . 58.2 t -114.98 142.65 27.02 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 CA-C-O 121.023 0.44 . . . . 0.0 109.924 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 89.1 mt -113.05 133.36 55.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -116.29 134.41 54.93 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 408' ' ' TRP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 450' ' ' MET . 14.4 p-90 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -173.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.367 0 CA-C-O 120.434 0.159 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 426' ' ' SER . . . . . 0.536 ' HB2' HG12 ' A' ' 405' ' ' VAL . 60.4 p -131.65 159.27 38.81 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -170.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 427' ' ' LEU . . . . . 0.446 HD13 HD11 ' A' ' 483' ' ' LEU . 50.8 mt -127.09 135.32 27.22 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.651 0.78 . . . . 0.0 110.021 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -82.47 132.6 6.92 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.821 2.347 . . . . 0.0 112.208 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 23.7 p -143.71 163.85 32.12 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.377 0.608 . . . . 0.0 112.212 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -116.77 130.06 56.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 43.0 t -117.64 123.78 72.19 Favored 'Isoleucine or valine' 0 C--O 1.268 2.059 0 CA-C-O 122.071 0.938 . . . . 0.0 110.768 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -109.88 158.24 18.39 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.436 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 433' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 471' ' ' VAL . 33.4 m -121.67 141.52 41.77 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.37 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 434' ' ' ASN . . . . . 0.521 ' HB2' ' CB ' ' A' ' 470' ' ' MET . 92.2 m-20 -94.51 130.28 40.98 Favored 'General case' 1 C--O 1.308 4.147 0 N-CA-C 103.3 -2.852 . . . . 0.0 103.3 163.927 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 435' ' ' HIS . . . . . 0.438 ' HB3' ' CD2' ' A' ' 399' ' ' LEU 0.309 31.6 p-80 -63.47 -175.91 0.14 Allowed 'General case' 0 N--CA 1.426 -1.641 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 -160.919 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.44 -11.25 33.28 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 105.337 -3.105 . . . . 0.0 105.337 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -128.91 149.02 50.96 Favored 'General case' 0 N--CA 1.383 -3.811 0 C-N-CA 127.306 2.242 . . . . 0.0 105.958 177.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -161.73 102.88 1.18 Allowed 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -137.82 151.9 48.57 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.647 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -94.6 123.09 37.83 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 170.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' THR . . . . . 0.496 HG21 ' HB2' ' A' ' 402' ' ' TRP . 11.7 p -83.45 38.12 0.6 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -170.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -75.64 -23.74 56.37 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.89 0.853 . . . . 0.0 109.079 175.87 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -88.48 -0.78 57.58 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.541 -177.166 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -99.71 131.5 24.58 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.826 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -69.18 162.76 40.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.73 1.62 . . . . 0.0 108.965 172.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -80.45 -7.23 59.07 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.068 -0.395 . . . . 0.0 110.849 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 56.4 mtpt -126.97 126.95 44.06 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.996 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 64.2 mt -113.26 148.46 35.52 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.881 177.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.38 122.8 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 -173.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 450' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 408' ' ' TRP . 79.9 mtp -100.14 118.5 36.61 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.642 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -110.81 113.87 26.79 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.1 mt -76.49 127.25 32.47 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 31.3 pt -136.59 161.6 60.98 Favored Pre-proline 0 C--N 1.309 -1.177 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.42 128.85 15.02 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 CA-C-N 120.109 1.075 . . . . 0.0 111.569 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -62.97 -26.35 68.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.164 0.986 . . . . 0.0 110.698 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -57.48 -38.63 74.83 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.649 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 63.9 mt -87.06 -2.06 58.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.954 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.8 tt -72.78 -24.19 60.9 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.302 0.641 . . . . 0.0 111.284 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.5 m -57.03 -31.51 65.23 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.675 0.79 . . . . 0.0 112.045 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.8 m -71.86 -18.04 62.09 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 121.3 0.571 . . . . 0.0 111.951 -177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.18 0.85 52.68 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.851 -0.531 . . . . 0.0 111.539 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' GLY . . . . . 0.413 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -39.7 -52.32 3.12 Favored Glycine 0 CA--C 1.551 2.288 0 CA-C-N 114.4 -1.273 . . . . 0.0 115.355 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 463' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 6.8 Cg_endo -50.25 -33.17 35.45 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.534 2.823 . . . . 0.0 114.021 178.222 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.64 -38.42 65.02 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 110.18 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -69.04 -13.62 62.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.537 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.23 -11.61 59.61 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.568 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.17 92.05 2.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.277 1.037 . . . . 0.0 108.995 171.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 61.7 m -148.14 169.86 19.08 Favored 'General case' 0 N--CA 1.422 -1.868 0 CA-C-O 121.987 0.898 . . . . 0.0 111.922 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' ARG . . . . . 0.422 ' HG3' ' HB ' ' A' ' 526' ' ' ILE . 10.7 ptm180 -111.29 142.16 43.88 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 126.739 2.016 . . . . 0.0 107.384 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' MET . . . . . 0.521 ' CB ' ' HB2' ' A' ' 434' ' ' ASN . 2.7 mmm -97.62 148.84 22.89 Favored 'General case' 0 CA--C 1.483 -1.628 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.673 -173.464 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 433' ' ' VAL . 21.4 m -138.32 151.6 24.91 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -127.01 128.89 47.06 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' PHE . . . . . 0.436 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 22.1 m-85 -107.77 116.54 32.14 Favored 'General case' 0 C--O 1.271 2.226 0 CA-C-O 121.867 0.841 . . . . 0.0 110.419 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -123.57 122.57 38.52 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 105.898 -1.889 . . . . 0.0 105.898 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 C--N 1.292 -1.919 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -177.953 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.22 -51.53 20.65 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 118.944 0.793 . . . . 0.0 110.929 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 17.9 m -71.27 -47.55 56.28 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -173.159 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 487' ' ' TYR . 8.0 mp -73.87 -19.27 60.77 Favored 'General case' 0 C--O 1.193 -1.878 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.389 -177.493 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -62.52 -34.43 76.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.621 0.724 . . . . 0.0 109.158 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -69.77 -47.13 50.04 Favored Glycine 0 N--CA 1.438 -1.205 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.872 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -39.21 90.71 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.942 0.897 . . . . 0.0 111.729 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' TYR . . . . . 0.467 ' CE1' ' HB3' ' A' ' 483' ' ' LEU . 6.0 m-30 -61.19 -40.36 93.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.631 0.373 . . . . 0.0 110.369 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -67.13 -38.23 85.2 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.088 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 485' ' ' GLY . 64.0 mt -64.19 -49.51 80.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.08 0.466 . . . . 0.0 110.149 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 15.4 mmt -63.85 -35.5 80.83 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.29 -14.38 81.97 Favored Glycine 0 CA--C 1.527 0.828 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.078 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -84.17 -0.91 53.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.585 0.707 . . . . 0.0 109.676 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.89 29.99 6.99 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.861 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -107.02 161.6 14.59 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 120.945 0.403 . . . . 0.0 111.139 176.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -136.28 160.11 39.71 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -120.49 106.04 1.13 Allowed Glycine 0 N--CA 1.423 -2.221 0 C-N-CA 119.712 -1.233 . . . . 0.0 111.33 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' CYS . . . . . 0.426 ' SG ' HG21 ' A' ' 537' ' ' ILE . 49.9 t -82.88 123.38 29.33 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.95 120.85 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.131 0 CA-C-O 121.477 0.656 . . . . 0.0 110.165 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -107.74 143.48 36.2 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.562 -1.199 . . . . 0.0 108.377 176.004 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -98.68 129.77 29.34 Favored Pre-proline 0 C--N 1.285 -2.211 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.634 -175.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo . . . . . 0 CA--C 1.542 0.907 0 C-N-CA 122.402 2.068 . . . . 0.0 110.845 172.672 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 N--CA 1.441 -0.924 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 73.86 149.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.986 1.314 . . . . 0.0 109.222 -178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.5 m -122.38 160.15 24.84 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.041 0 C-N-CA 117.326 -1.75 . . . . 0.0 111.883 -174.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.549 ' HB2' HG12 ' A' ' 526' ' ' ILE . 13.5 tp -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -170.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 43.0 tpp -109.56 114.4 28.0 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.531 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -101.35 123.98 46.3 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.264 0.554 . . . . 0.0 110.037 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 72.7 mt -126.35 148.87 49.5 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.311 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -97.96 130.48 44.81 Favored 'General case' 0 C--N 1.273 -2.72 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.301 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 46.1 t -102.5 109.97 21.77 Favored 'General case' 0 N--CA 1.411 -2.379 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 33.7 p -69.64 -19.81 63.61 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.531 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -65.52 -44.32 87.32 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.037 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' LYS . . . . . 0.413 ' HB2' HG13 ' A' ' 521' ' ' ILE . 67.4 mttm -105.85 -9.86 16.97 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.426 -177.109 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 69.14 28.72 4.9 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.084 0.954 . . . . 0.0 110.737 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 521' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 519' ' ' LYS . 2.5 pp -134.62 168.82 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.835 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.022 -175.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 522' ' ' PHE . . . . . 0.531 ' HB3' HD11 ' A' ' 513' ' ' LEU . 19.2 m-85 -104.67 139.61 39.26 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.203 -172.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 22.9 mmt -124.17 160.31 28.14 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.89 153.6 21.13 Favored Glycine 0 N--CA 1.416 -2.634 0 C-N-CA 118.805 -1.664 . . . . 0.0 112.823 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -114.69 140.02 49.19 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 172.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.0 mt -108.21 107.6 60.35 Favored Pre-proline 0 N--CA 1.427 -1.585 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 33.5 Cg_exo -68.09 133.86 30.05 Favored 'Trans proline' 0 C--O 1.296 3.388 0 C-N-CA 122.441 2.094 . . . . 0.0 112.846 171.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.2 -35.2 68.87 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 113.092 -1.867 . . . . 0.0 106.848 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.11 65.73 0.81 Allowed 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.291 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -66.78 -38.04 85.77 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.59 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 12.2 m -63.81 -41.6 97.85 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 -177.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.42 -42.9 21.48 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.0 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -64.33 -47.47 79.26 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.197 0.199 . . . . 0.0 111.337 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.97 -39.04 82.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.02 -37.64 87.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.368 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -72.41 -47.3 29.2 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.385 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' ILE . . . . . 0.426 HG21 ' SG ' ' A' ' 497' ' ' CYS . 38.9 mm -62.97 -33.92 63.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 122.963 0.505 . . . . 0.0 111.837 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -56.14 -42.08 76.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 122.922 0.489 . . . . 0.0 110.034 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -66.2 -41.56 90.02 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.811 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 71.7 t -60.89 -44.87 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.043 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 90.3 mt -62.4 -45.72 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.84 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 19.0 m -67.48 -36.54 81.32 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.412 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -66.94 -37.03 83.56 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 C--O 1.224 -0.279 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.795 174.928 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 26.1 ptm . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 47.4 t 68.74 -50.87 0.58 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.515 1.526 . . . . 0.0 113.33 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 89.3 t -67.36 103.74 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 C-N-CA 123.32 0.648 . . . . 0.0 110.458 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 9.7 t -141.62 -15.23 0.83 Allowed 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.697 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -76.25 -51.03 12.87 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 398' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -145.23 135.55 24.07 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.825 178.478 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 399' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 399' ' ' LEU . 2.9 mp -102.03 134.52 45.12 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -174.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.77 124.72 27.76 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.03 -41.24 2.77 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.456 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 54.9 t90 -148.8 149.71 31.82 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -173.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.6 m -138.98 117.67 12.24 Favored 'General case' 0 C--N 1.275 -2.643 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.456 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -160.58 -172.46 27.87 Favored Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.8 t -108.98 142.11 22.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -175.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.444 ' HG ' ' SG ' ' A' ' 429' ' ' CYS . 86.0 mt -113.12 141.46 46.88 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.503 ' OE2' ' HG2' ' A' ' 447' ' ' LYS . 35.8 mt-10 -116.04 125.18 52.1 Favored 'General case' 0 N--CA 1.405 -2.688 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 174.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 408' ' ' TRP . . . . . 0.44 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 64.9 p-90 -117.4 139.49 50.81 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.452 -173.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -110.59 136.62 49.41 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.89 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -78.97 -30.71 44.61 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.588 177.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 411' ' ' LYS . . . . . 0.469 ' HB3' ' HG2' ' A' ' 422' ' ' LYS 0.304 17.0 ttpt -150.4 109.63 3.18 Favored Pre-proline 0 C--N 1.295 -1.768 0 N-CA-C 104.586 -2.375 . . . . 0.0 104.586 -165.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -94.29 -31.42 0.06 OUTLIER 'Trans proline' 0 CA--C 1.539 0.734 0 N-CA-C 118.754 2.559 . . . . 0.0 118.754 -165.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -55.94 114.06 6.84 Favored Pre-proline 0 C--O 1.243 0.741 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -167.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.37 103.79 1.44 Allowed 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 122.864 2.376 . . . . 0.0 107.122 170.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 415' ' ' ALA . . . . . 0.426 ' HB3' ' HB3' ' A' ' 418' ' ' ASP . . . -92.56 1.68 57.12 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -169.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 33.1 m 71.16 -49.58 0.68 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.418 1.087 . . . . 0.0 111.678 -178.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 26.8 m -70.91 -16.65 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 171.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 418' ' ' ASP . . . . . 0.445 ' OD2' ' HA ' ' A' ' 421' ' ' THR . 28.8 t70 -110.13 89.92 3.16 Favored 'General case' 0 N--CA 1.426 -1.657 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 172.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -78.85 -38.24 38.4 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.987 -177.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -89.8 84.13 6.24 Favored 'General case' 0 CA--C 1.491 -1.304 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 421' ' ' THR . . . . . 0.445 ' HA ' ' OD2' ' A' ' 418' ' ' ASP . 64.7 m -73.27 82.9 1.37 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.03 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 422' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 422' ' ' LYS . 10.1 mptt 57.2 -175.88 0.06 Allowed 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.363 -1.744 . . . . 0.0 113.744 172.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 91.4 mt -103.32 133.38 48.48 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.97 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 17.0 m -106.46 139.56 40.75 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 425' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 38.1 mmt180 -120.49 146.37 46.33 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.003 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 27.7 p -108.89 144.84 36.28 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 123.635 0.584 . . . . 0.0 110.987 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 20.9 tp -146.97 126.89 6.7 Favored Pre-proline 0 C--N 1.305 -1.363 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.97 142.05 24.59 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.396 2.064 . . . . 0.0 112.17 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 429' ' ' CYS . . . . . 0.444 ' SG ' ' HG ' ' A' ' 406' ' ' LEU . 26.0 p -144.29 163.49 33.56 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.376 0.608 . . . . 0.0 111.78 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -117.25 129.18 55.75 Favored 'General case' 0 N--CA 1.423 -1.792 0 N-CA-C 104.404 -2.443 . . . . 0.0 104.404 174.014 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 48.0 t -117.17 125.29 73.86 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.973 0 CA-C-O 121.794 0.807 . . . . 0.0 110.384 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -108.04 160.98 15.37 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 30.5 m -121.25 141.29 42.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.148 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.709 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 53.8 t30 -94.1 131.31 39.75 Favored 'General case' 1 C--O 1.359 6.855 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 173.952 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -38.43 148.1 0.05 OUTLIER 'General case' 0 C--N 1.363 1.161 3 O-C-N 130.865 5.103 . . . . 0.0 118.987 -161.856 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.51 -18.44 35.34 Favored Glycine 0 CA--C 1.494 -1.273 0 CA-C-N 112.528 -2.124 . . . . 0.0 110.858 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.606 ' OE2' ' HA ' ' A' ' 469' ' ' ARG . 5.6 mm-40 -98.07 118.0 33.69 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 114.329 -0.936 . . . . 0.0 110.806 -170.262 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -108.73 108.45 19.28 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -138.23 156.02 48.08 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -102.39 121.38 42.21 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-O 121.316 0.579 . . . . 0.0 111.034 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.402 HG21 ' HB2' ' A' ' 402' ' ' TRP . 4.3 p -88.71 -13.59 39.29 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -174.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.96 -19.01 65.72 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.567 0.699 . . . . 0.0 109.626 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -82.1 -10.87 59.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.448 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -84.0 141.76 40.99 Favored Pre-proline 0 C--O 1.245 0.864 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -67.31 163.18 35.48 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.567 2.178 . . . . 0.0 109.799 171.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -81.84 -9.93 59.47 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.503 ' HG2' ' OE2' ' A' ' 407' ' ' GLU . 1.8 mptm? -124.47 135.99 53.67 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.915 172.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 448' ' ' LEU . . . . . 0.43 HD22 ' CD1' ' A' ' 500' ' ' PHE . 56.3 mt -118.5 146.69 44.33 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 59.1 mt -98.82 116.93 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 22.5 ptm -122.87 134.32 54.39 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.429 0.633 . . . . 0.0 112.186 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -116.71 133.82 55.55 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.52 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -81.58 110.37 16.89 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.296 0.569 . . . . 0.0 110.013 177.307 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 2.4 pp -118.4 152.95 51.59 Favored Pre-proline 0 C--N 1.301 -1.519 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.713 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.96 128.69 20.24 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 121.032 1.155 . . . . 0.0 113.159 -177.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.27 -25.88 68.52 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.137 1.375 . . . . 0.0 110.595 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -57.28 -41.16 79.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.461 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 8.3 mp -85.88 -8.89 57.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.984 0.421 . . . . 0.0 111.219 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.49 -20.0 55.01 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.201 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 11.4 m -57.52 -28.72 63.74 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.015 0.926 . . . . 0.0 110.489 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.55 -22.42 65.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.094 -177.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.59 9.64 42.8 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.653 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -42.7 -55.89 4.49 Favored Glycine 0 CA--C 1.543 1.835 0 N-CA-C 116.31 1.284 . . . . 0.0 116.31 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.75 -19.79 59.22 Favored 'Trans proline' 0 C--N 1.362 1.289 0 CA-C-N 120.122 1.961 . . . . 0.0 113.17 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.22 -22.37 55.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.358 0.599 . . . . 0.0 109.997 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.0 -13.54 61.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.957 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -72.61 -9.87 59.12 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.53 81.29 1.88 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.155 0.978 . . . . 0.0 110.164 173.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 468' ' ' SER . . . . . 0.425 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 51.8 m -155.35 169.42 24.26 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.239 -175.345 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.606 ' HA ' ' OE2' ' A' ' 437' ' ' GLU . 0.1 OUTLIER -109.79 141.72 42.04 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -176.941 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.709 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 41.1 mtp -97.7 149.04 22.72 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 113.593 -3.243 . . . . 0.0 111.347 -172.972 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 11.6 m -135.17 160.58 40.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.371 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -139.77 133.62 30.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 65.2 m-85 -107.95 125.3 51.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-O 121.628 0.728 . . . . 0.0 110.748 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -121.32 123.2 41.59 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' PHE . . . . . 0.416 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 78.1 m-85 -90.03 143.73 26.52 Favored 'General case' 0 C--N 1.287 -2.139 0 C-N-CA 119.535 -0.866 . . . . 0.0 113.075 -174.579 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 22.2 m -80.83 99.35 8.25 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.917 -1.883 . . . . 0.0 105.917 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -66.84 78.55 0.12 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.471 ' HG3' ' OD2' ' A' ' 479' ' ' ASP . 0.3 OUTLIER -80.89 -49.32 11.17 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.862 -1.517 . . . . 0.0 107.625 172.395 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 479' ' ' ASP . . . . . 0.471 ' OD2' ' HG3' ' A' ' 478' ' ' LYS . 0.9 OUTLIER -124.82 95.7 4.61 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.126 -177.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.27 -27.02 68.72 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.077 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -65.6 -40.64 92.9 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.622 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.8 m -66.54 -41.42 88.74 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.36 -48.18 80.92 Favored 'General case' 0 C--O 1.201 -1.495 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.777 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 37.5 ttpt -55.35 -47.03 76.34 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 123.517 0.727 . . . . 0.0 110.868 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -63.24 -43.23 98.84 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.473 HD21 ' SD ' ' A' ' 490' ' ' MET . 9.5 tt -66.28 -38.58 88.11 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 123.19 0.596 . . . . 0.0 110.91 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -56.55 -41.39 76.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.172 0.589 . . . . 0.0 110.714 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 484' ' ' LYS . 24.8 mmt180 -60.97 -47.26 87.28 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 75.9 mt -68.44 -52.8 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.981 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' MET . . . . . 0.473 ' SD ' HD21 ' A' ' 486' ' ' LEU . 87.3 mtp -76.18 -23.1 54.7 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.046 -0.662 . . . . 0.0 112.184 -175.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -81.41 -12.1 82.41 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.085 -0.578 . . . . 0.0 111.737 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -92.75 3.8 54.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.67 0.748 . . . . 0.0 110.008 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.93 30.15 6.54 Favored Glycine 0 N--CA 1.435 -1.4 0 C-N-CA 119.63 -1.271 . . . . 0.0 113.159 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -104.71 141.0 37.24 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 170.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ALA . . . . . 0.42 ' HB1' ' SD ' ' A' ' 512' ' ' MET . . . -118.54 147.91 43.19 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -178.633 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -104.12 104.88 2.51 Favored Glycine 0 N--CA 1.421 -2.352 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 537' ' ' ILE . 42.1 t -82.88 119.83 24.89 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.335 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 498' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 511' ' ' LEU . 61.5 t -101.25 121.17 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.645 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -109.01 137.94 46.13 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' PHE . . . . . 0.461 ' HD2' ' O ' ' A' ' 509' ' ' ARG . 95.5 m-85 -92.49 133.82 29.05 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.62 160.18 12.25 Favored 'Trans proline' 0 C--O 1.25 1.087 0 C-N-CA 122.156 1.904 . . . . 0.0 110.604 172.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -76.14 127.83 33.73 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 121.46 0.648 . . . . 0.0 110.227 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 7.0 t -158.49 -38.58 0.06 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -83.78 153.68 64.34 Favored Pre-proline 0 N--CA 1.441 -0.919 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -47.83 -32.81 18.03 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 124.364 3.376 . . . . 0.0 116.39 -173.646 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 27.6 m -104.29 -75.24 0.62 Allowed 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.867 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -168.77 26.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.409 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 31.6 t 67.35 -97.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.377 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.461 ' O ' ' HD2' ' A' ' 500' ' ' PHE . 96.8 mtt180 -169.76 -176.95 2.52 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.193 -3.262 . . . . 0.0 102.193 -174.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.8 m -134.93 155.97 39.04 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.749 0 CA-C-N 120.832 1.651 . . . . 0.0 111.235 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.618 HD13 ' HB ' ' A' ' 526' ' ' ILE . 40.6 tp -125.52 148.84 48.74 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-O 120.899 0.38 . . . . 0.0 111.609 -172.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' MET . . . . . 0.42 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 39.0 tpp -113.78 138.76 49.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 175.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' A' ' 522' ' ' PHE . 0.9 OUTLIER -117.5 124.84 49.73 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.072 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.41 139.81 50.59 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 123.605 0.762 . . . . 0.0 109.588 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -94.27 122.94 37.33 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.926 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.9 p -105.83 110.62 22.98 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 12.4 m -68.45 -32.11 71.89 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.391 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -63.24 -41.52 99.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.845 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -94.09 -5.91 46.25 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.9 tptt 62.55 21.36 12.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.402 1.481 . . . . 0.0 110.512 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.06 167.77 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.868 -173.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 61.3 m-85 -96.46 139.41 32.6 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -128.39 165.9 19.72 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -177.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 524' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -178.39 153.7 13.32 Favored Glycine 0 N--CA 1.426 -2.01 0 C-N-CA 119.353 -1.403 . . . . 0.0 112.545 175.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.488 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 8.5 mp -115.19 140.04 49.42 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 122.344 0.258 . . . . 0.0 110.429 174.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.618 ' HB ' HD13 ' A' ' 511' ' ' LEU . 3.0 tt -109.21 108.11 60.12 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-O 120.899 0.381 . . . . 0.0 111.903 177.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.52 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 31.8 Cg_exo -69.86 140.35 42.1 Favored 'Trans proline' 0 C--O 1.283 2.766 0 C-N-CA 123.637 2.891 . . . . 0.0 112.764 171.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -70.64 -44.78 66.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 113.555 -1.657 . . . . 0.0 110.316 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -85.16 101.88 12.83 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.575 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -31.98 72.59 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.956 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 18.5 m -59.3 -48.3 82.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.8 -40.36 37.01 Favored Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.179 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.507 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 34.3 t80 -70.59 -46.82 62.7 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.647 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.97 -38.89 81.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -57.54 -46.07 84.31 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.461 0.304 . . . . 0.0 110.352 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' GLY . . . . . 0.408 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -64.6 -42.05 97.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.644 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 541' ' ' ILE . 48.2 mm -66.88 -35.82 75.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 122.12 0.168 . . . . 0.0 110.945 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.1 -41.35 75.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.956 0.503 . . . . 0.0 110.144 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -63.0 -45.82 90.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.655 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 536' ' ' GLY . 55.7 t -62.4 -45.9 97.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.34 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 537' ' ' ILE . 66.7 mt -65.44 -45.43 92.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 C-N-CA 122.343 0.257 . . . . 0.0 111.42 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.6 t -67.22 -35.73 80.2 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.949 -178.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -67.73 -42.16 82.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.195 0.521 . . . . 0.0 109.787 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.28 -38.92 92.76 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.67 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -70.67 -38.11 73.73 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 176.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.76 -39.51 91.13 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -71.93 -58.79 3.15 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 51.83 86.81 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.671 1.988 . . . . 0.0 112.742 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 38.7 t60 -115.98 32.01 6.37 Favored 'General case' 0 C--N 1.307 -1.245 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 51.0 m-70 -101.53 156.12 17.67 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.405 -1.271 . . . . 0.0 108.033 -178.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 71.7 m80 . . . . . 0 C--N 1.29 -1.996 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 178.887 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 CA--C 1.503 -0.846 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 36.9 m -90.18 14.44 12.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.233 0.539 . . . . 0.0 111.728 -177.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 19.6 m -91.75 81.83 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-O 122.156 0.979 . . . . 0.0 109.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 16.2 m -102.54 -7.69 21.65 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.997 -174.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -130.58 -53.89 1.08 Allowed 'General case' 0 CA--C 1.496 -1.119 0 CA-C-O 121.217 0.532 . . . . 0.0 109.576 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 398' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -128.35 132.72 48.57 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 178.112 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.94 118.48 36.92 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.281 -175.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.53 126.36 27.62 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 176.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -132.55 -46.0 0.89 Allowed 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.453 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 61.4 t90 -147.81 143.42 27.47 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.376 -176.096 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 43.8 t -127.44 118.05 23.31 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.453 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -163.07 -172.51 30.65 Favored Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.968 -175.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 53.3 t -113.28 141.4 29.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.304 0.642 . . . . 0.0 109.354 -176.059 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.9 mp -114.08 140.54 48.39 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.081 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.562 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 69.0 mt-10 -115.61 126.05 53.7 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.606 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -122.74 153.66 39.17 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.483 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -100.94 138.75 37.58 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.114 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.79 -7.53 34.96 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.318 1.047 . . . . 0.0 110.885 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 56.2 tptt 64.43 86.67 0.13 Allowed Pre-proline 0 N--CA 1.453 -0.292 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -169.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.69 108.23 0.11 Allowed 'Trans proline' 0 C--O 1.245 0.841 0 C-N-CA 124.627 3.551 . . . . 0.0 115.86 -170.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.24 93.64 23.0 Favored Pre-proline 0 C--N 1.298 -1.644 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 171.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.62 112.28 1.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.95 1.767 . . . . 0.0 111.194 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -75.86 -3.05 33.06 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.902 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 25.5 m 74.31 16.44 3.38 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.906 1.282 . . . . 0.0 111.815 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 52.3 t -83.33 -35.7 12.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 173.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -120.22 151.78 38.65 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 104.794 -2.298 . . . . 0.0 104.794 174.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -71.39 -37.69 71.55 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 118.278 0.49 . . . . 0.0 112.112 -176.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -150.63 123.89 8.89 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.606 0.717 . . . . 0.0 110.765 -179.806 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 4.9 t -138.41 107.52 6.05 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.418 0.628 . . . . 0.0 111.044 -173.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -104.15 82.77 2.0 Allowed 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 53.4 tp -78.84 118.53 20.97 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.269 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 3.4 m -106.61 139.85 40.4 Favored 'General case' 0 N--CA 1.419 -1.981 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 15.4 mmm180 -114.22 145.73 41.32 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.562 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 5.4 p -122.42 133.39 54.62 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.259 0.349 . . . . 0.0 110.825 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 95.0 mt -133.54 126.22 19.0 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.191 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.62 135.2 14.35 Favored 'Trans proline' 0 C--O 1.249 1.053 0 C-N-CA 122.263 1.975 . . . . 0.0 110.941 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 429' ' ' CYS . . . . . 0.577 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 20.8 p -143.21 167.02 23.1 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.336 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -117.13 129.64 56.1 Favored 'General case' 0 N--CA 1.413 -2.29 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 47.7 t -112.16 122.61 66.76 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-O 122.431 1.11 . . . . 0.0 109.958 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -108.72 160.22 16.13 Favored 'General case' 0 N--CA 1.397 -3.078 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 25.8 m -120.87 140.75 44.04 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.026 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.269 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.526 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 25.7 t-20 -95.72 131.03 42.43 Favored 'General case' 1 C--O 1.326 5.094 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.712 179.011 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -27.56 131.51 0.04 OUTLIER 'General case' 0 C--O 1.244 0.808 0 O-C-N 127.288 2.867 . . . . 0.0 113.576 -170.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 111.02 -3.11 28.56 Favored Glycine 0 N--CA 1.421 -2.302 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 -173.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.524 ' HB2' ' HB3' ' A' ' 469' ' ' ARG . 12.7 tt0 -115.87 111.89 21.12 Favored 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 173.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -136.44 97.68 3.64 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -139.19 157.88 45.15 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -90.42 108.0 19.5 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 175.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -74.43 31.42 0.09 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.382 1.073 . . . . 0.0 112.973 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -66.98 -46.83 73.43 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.628 1.171 . . . . 0.0 112.721 -174.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -92.88 15.23 15.28 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.876 0.37 . . . . 0.0 111.452 -176.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 8.4 m0 -76.79 129.53 78.78 Favored Pre-proline 0 C--N 1.311 -1.072 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.74 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -70.96 163.54 38.88 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.45 2.1 . . . . 0.0 109.762 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -85.68 -6.08 59.18 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 93.8 mttt -127.73 132.79 49.55 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.5 mt -118.8 146.19 45.02 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.214 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.3 128.24 55.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 80.6 mtp -100.75 125.39 47.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.262 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -107.97 113.54 26.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 7.9 mp -85.35 124.74 32.31 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.246 0.546 . . . . 0.0 111.587 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.467 HD11 ' HE1' ' A' ' 512' ' ' MET . 22.5 pt -134.5 161.04 66.08 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.456 -177.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 454' ' ' PRO . . . . . 0.425 ' HD3' HD23 ' A' ' 544' ' ' LEU . 37.3 Cg_endo -72.04 128.68 14.26 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 120.064 1.059 . . . . 0.0 112.518 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -63.7 -30.36 71.47 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.623 1.169 . . . . 0.0 110.553 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.08 -36.13 82.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.892 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 540' ' ' VAL . 34.1 tp -87.29 -5.55 58.88 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.632 0.73 . . . . 0.0 111.022 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 59.1 tp -78.01 -16.12 58.36 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.791 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 22.5 p -57.59 -29.21 64.28 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 124.101 0.96 . . . . 0.0 113.101 -174.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 21.4 m -63.18 -29.75 71.04 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-O 121.102 0.477 . . . . 0.0 110.757 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.14 7.92 29.36 Favored 'General case' 0 C--O 1.222 -0.391 0 O-C-N 122.193 -0.317 . . . . 0.0 111.55 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -46.1 -58.03 5.91 Favored Glycine 0 CA--C 1.543 1.792 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.9 -22.84 75.49 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 122.672 2.248 . . . . 0.0 113.336 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.8 tp -72.43 -29.87 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.016 0.436 . . . . 0.0 109.899 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -75.22 -13.19 60.43 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.297 -0.865 . . . . 0.0 113.073 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' ARG . . . . . 0.474 ' NE ' ' HA ' ' A' ' 466' ' ' ARG . 5.0 mmp_? -61.78 -46.2 90.6 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.106 -0.638 . . . . 0.0 111.946 -177.376 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -95.13 84.29 4.06 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' SER . . . . . 0.424 ' HB2' HD23 ' A' ' 525' ' ' LEU . 66.0 m -148.24 169.99 18.86 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.922 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.524 ' HB3' ' HB2' ' A' ' 437' ' ' GLU . 8.0 mtm180 -111.13 141.98 43.92 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 -175.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.545 ' HG2' ' HG ' ' A' ' 525' ' ' LEU . 47.5 mtp -99.73 152.71 19.79 Favored 'General case' 0 N--CA 1.425 -1.717 0 C-N-CA 116.837 -1.945 . . . . 0.0 110.75 -173.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 23.1 m -134.0 159.45 42.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.661 178.031 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -129.44 119.87 24.52 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.752 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -107.42 119.87 40.61 Favored 'General case' 0 C--O 1.29 3.199 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.296 -177.684 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.23 123.22 27.97 Favored 'General case' 0 N--CA 1.42 -1.96 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 174.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 41.2 m-85 -78.49 144.14 36.0 Favored 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.002 -176.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 7.1 m -52.47 -41.5 63.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.816 1.246 . . . . 0.0 109.558 -177.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' ASN . . . . . 0.465 ' C ' ' H ' ' A' ' 479' ' ' ASP . 14.0 m-80 -127.7 142.7 51.26 Favored 'General case' 0 CA--C 1.43 -3.65 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 168.666 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' A' ' 483' ' ' LEU . 58.0 mtpt -65.12 -2.37 2.8 Favored 'General case' 0 C--N 1.291 -1.941 0 O-C-N 124.06 0.85 . . . . 0.0 110.116 173.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 477' ' ' ASN . 2.3 t70 45.78 66.27 0.97 Allowed 'General case' 0 CA--C 1.43 -3.637 0 C-N-CA 127.95 2.5 . . . . 0.0 107.938 176.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 480' ' ' LEU . 20.0 mt -46.96 -41.29 15.9 Favored 'General case' 0 C--N 1.275 -2.648 0 CA-C-N 110.944 -2.844 . . . . 0.0 112.963 -168.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -72.23 -53.79 11.53 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.035 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 7.0 m -73.88 -47.94 34.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -172.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 478' ' ' LYS . 30.4 mt -71.07 -22.39 62.12 Favored 'General case' 0 C--O 1.19 -2.029 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -174.96 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -55.81 -42.65 75.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -70.0 -44.5 61.07 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.13 175.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -41.67 97.23 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 487' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 483' ' ' LEU . 7.0 m-30 -56.23 -42.36 77.14 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.393 0.677 . . . . 0.0 109.774 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.29 -48.05 79.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.197 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 68.6 mt -62.2 -50.54 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 123.577 0.548 . . . . 0.0 111.341 -178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 91.6 mmm -63.65 -43.01 98.02 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.363 0.601 . . . . 0.0 110.427 -177.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -70.34 -12.8 69.88 Favored Glycine 0 CA--C 1.521 0.464 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.685 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -88.5 11.04 18.18 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.287 1.041 . . . . 0.0 109.201 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.91 30.07 6.94 Favored Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.106 177.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -113.38 145.16 41.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 117.098 0.449 . . . . 0.0 111.367 176.217 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -124.46 153.47 41.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -114.16 107.39 1.85 Allowed Glycine 0 N--CA 1.422 -2.24 0 C-N-CA 120.34 -0.933 . . . . 0.0 111.204 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 49.5 t -82.42 121.04 26.21 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.0 t -100.8 120.8 50.79 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.197 0 CA-C-O 121.687 0.756 . . . . 0.0 109.588 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -107.6 143.23 36.35 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.84 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -100.19 129.26 28.57 Favored Pre-proline 0 C--N 1.284 -2.268 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.61 -176.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -60.87 134.88 56.09 Favored 'Trans proline' 0 C--O 1.245 0.858 0 N-CA-C 107.19 -1.889 . . . . 0.0 107.19 169.175 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -78.28 114.15 16.91 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 118.5 -1.28 . . . . 0.0 113.373 -173.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 21.0 m -111.72 -36.46 5.45 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.98 117.37 68.64 Favored Pre-proline 0 N--CA 1.429 -1.514 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 169.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -83.06 -2.03 10.61 Favored 'Trans proline' 0 C--N 1.328 -0.541 0 C-N-CA 122.407 2.071 . . . . 0.0 114.192 -177.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 59.8 m -111.79 -78.42 0.58 Allowed 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -121.28 117.45 27.05 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 120.959 0.409 . . . . 0.0 109.913 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.64 -31.45 2.27 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.484 ' HG2' ' HA ' ' A' ' 528' ' ' TYR . 4.7 mtm180 72.69 165.47 0.29 Allowed 'General case' 0 C--N 1.373 1.612 0 C-N-CA 124.853 1.261 . . . . 0.0 109.071 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 15.9 m -128.63 163.92 32.0 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.945 0 C-N-CA 117.766 -1.574 . . . . 0.0 111.404 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.551 ' HB2' HG12 ' A' ' 526' ' ' ILE . 12.3 tp -125.88 145.87 50.07 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.279 0.561 . . . . 0.0 112.346 -173.206 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' MET . . . . . 0.467 ' HE1' HD11 ' A' ' 453' ' ' ILE . 38.5 tpp -115.24 117.81 31.55 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 174.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.533 HD11 ' HB3' ' A' ' 522' ' ' PHE . 48.3 tp -100.03 121.17 40.96 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 121.239 0.542 . . . . 0.0 109.995 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.17 130.02 51.81 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.45 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -90.13 127.45 36.1 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.8 p -101.46 110.76 22.81 Favored 'General case' 0 N--CA 1.401 -2.876 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 7.9 m -68.5 -34.36 75.76 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.197 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -74.46 -27.9 60.8 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.743 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -99.0 -9.89 23.37 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 120.461 -0.496 . . . . 0.0 109.861 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 59.74 31.01 20.59 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.467 1.107 . . . . 0.0 111.797 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -144.82 167.48 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.533 ' HB3' HD11 ' A' ' 513' ' ' LEU . 30.1 m-85 -102.56 138.33 39.61 Favored 'General case' 0 N--CA 1.42 -1.936 0 C-N-CA 119.321 -0.952 . . . . 0.0 110.283 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 25.8 ptm -127.01 159.57 33.73 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -165.89 153.08 22.79 Favored Glycine 0 N--CA 1.42 -2.38 0 C-N-CA 118.437 -1.839 . . . . 0.0 112.67 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.545 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 9.6 mp -115.58 139.21 50.3 Favored 'General case' 0 C--N 1.29 -1.987 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 171.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 511' ' ' LEU . 25.0 mt -105.67 107.46 59.41 Favored Pre-proline 0 N--CA 1.428 -1.558 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 25.4 Cg_exo -70.93 138.0 33.2 Favored 'Trans proline' 0 C--O 1.295 3.359 0 C-N-CA 123.027 2.485 . . . . 0.0 112.316 171.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' TYR . . . . . 0.484 ' HA ' ' HG2' ' A' ' 509' ' ' ARG . 96.9 m-85 -71.65 -41.43 68.79 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 113.3 -1.773 . . . . 0.0 110.28 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.48 89.71 3.84 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -67.5 -44.98 77.18 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.71 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.1 m -60.36 -46.85 88.47 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 112.818 0.674 . . . . 0.0 112.818 -174.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -75.85 -38.48 36.18 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.453 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 537' ' ' ILE . 46.4 t80 -63.98 -47.57 79.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 93.5 t -61.45 -38.85 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 121.09 0.471 . . . . 0.0 110.038 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -62.44 -41.18 98.55 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.352 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.99 -41.15 93.37 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 533' ' ' PHE . 46.7 mm -62.72 -35.52 71.05 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 122.757 0.423 . . . . 0.0 111.122 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -55.92 -38.59 70.46 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.05 0.452 . . . . 0.0 111.301 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 86.3 mt-30 -68.99 -44.27 73.2 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.301 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 457' ' ' LEU . 48.6 t -62.39 -42.26 94.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.176 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.439 ' O ' ' HG2' ' A' ' 545' ' ' GLU . 73.8 mt -60.54 -45.14 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.328 0.651 . . . . 0.0 109.708 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 60.2 m -58.7 -41.53 86.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.112 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -68.11 -42.93 79.53 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.455 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.425 HD23 ' HD3' ' A' ' 454' ' ' PRO . 2.8 tm? -60.12 -37.76 81.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.659 0.784 . . . . 0.0 111.726 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 545' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 541' ' ' ILE . 79.7 mm-40 -58.06 -32.88 68.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.102 0.477 . . . . 0.0 111.357 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -96.39 -20.91 18.1 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.854 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 38.3 m80 65.63 174.73 0.22 Allowed 'General case' 0 C--O 1.249 1.076 0 C-N-CA 124.774 1.23 . . . . 0.0 110.474 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 44.5 m80 -81.9 77.9 8.67 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 174.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 55.1 p-80 -96.04 14.71 22.84 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.426 -174.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -146.69 -56.31 0.26 Allowed 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.2 p80 . . . . . 0 C--N 1.296 -1.754 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.602 179.816 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 43.0 tpp . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 120.564 0.221 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 29.9 t -126.12 116.74 21.84 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 395' ' ' VAL . . . . . 0.484 HG13 ' H ' ' A' ' 397' ' ' ASN . 7.6 p -142.01 -32.97 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.205 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 21.1 t 62.78 38.8 11.45 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 397' ' ' ASN . . . . . 0.484 ' H ' HG13 ' A' ' 395' ' ' VAL . 3.2 p-10 -69.0 147.48 51.53 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.273 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 398' ' ' LYS . . . . . 0.564 ' H ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -127.93 153.66 46.43 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.647 -174.379 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 399' ' ' LEU . . . . . 0.402 ' HB2' HG23 ' A' ' 433' ' ' VAL . 2.9 mp -106.16 132.47 52.19 Favored 'General case' 0 C--N 1.265 -3.091 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -175.297 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.58 128.87 37.59 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -118.59 -62.88 1.48 Allowed 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.472 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 52.1 t90 -140.11 145.95 38.25 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.357 -171.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 20.6 t -126.26 121.52 32.91 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.472 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -169.56 -172.09 35.82 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.443 -175.131 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 49.7 t -109.55 139.23 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 448' ' ' LEU . 9.2 tp -113.91 132.2 56.01 Favored 'General case' 0 N--CA 1.409 -2.514 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -115.62 125.85 53.44 Favored 'General case' 0 N--CA 1.419 -2.012 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 -132.18 145.89 51.66 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 121.04 0.447 . . . . 0.0 111.143 -171.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -101.21 131.61 47.12 Favored 'General case' 0 N--CA 1.42 -1.954 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -78.96 -31.8 45.13 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.587 -177.528 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -94.47 116.45 66.41 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.706 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.41 -25.34 78.2 Favored 'Trans proline' 0 N--CA 1.485 0.996 0 C-N-CA 123.218 2.612 . . . . 0.0 113.773 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.411 ' HD3' ' O ' ' A' ' 544' ' ' LEU . 22.1 pttm -146.48 150.24 39.92 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.52 79.85 2.1 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.951 1.768 . . . . 0.0 111.081 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -99.07 2.94 46.58 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.68 -1.145 . . . . 0.0 108.613 178.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 58.5 m -53.6 116.8 2.67 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -175.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 21.4 t -118.84 17.81 6.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 102.757 -3.053 . . . . 0.0 102.757 166.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -107.7 137.35 45.87 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 112.405 -2.18 . . . . 0.0 111.628 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.62 -28.88 20.37 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.575 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -65.12 117.61 7.97 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 20.5 m 60.61 90.23 0.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 122.409 1.1 . . . . 0.0 110.945 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.57 6.07 19.83 Favored 'General case' 0 C--N 1.291 -1.945 0 O-C-N 121.625 -0.672 . . . . 0.0 109.397 -178.581 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 90.5 mt -110.69 147.28 34.67 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.815 -177.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 3.6 m -66.35 146.08 54.98 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.332 -1.359 . . . . 0.0 107.332 173.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -91.27 146.66 23.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 46.9 p -125.46 131.53 52.84 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.926 0.393 . . . . 0.0 111.484 -175.115 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 427' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 482' ' ' SER . 62.1 mt -136.16 127.38 16.94 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 122.754 0.422 . . . . 0.0 111.977 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -73.43 134.47 20.74 Favored 'Trans proline' 0 C--O 1.254 1.312 0 C-N-CA 122.385 2.056 . . . . 0.0 110.791 175.222 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.3 p -141.91 161.54 37.71 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.694 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -116.98 129.78 56.26 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.36 124.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.795 0 CA-C-O 121.739 0.78 . . . . 0.0 110.502 -175.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -107.86 155.37 20.35 Favored 'General case' 0 C--N 1.28 -2.428 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 471' ' ' VAL . 18.1 m -122.27 139.31 49.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.635 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 37.0 t30 -98.33 130.86 45.0 Favored 'General case' 1 C--O 1.309 4.219 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.502 168.703 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.485 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 80.0 m80 -19.53 152.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 131.166 3.786 . . . . 0.0 118.201 -170.304 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 110.76 -1.16 28.89 Favored Glycine 0 C--O 1.244 0.769 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.488 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.567 ' HG3' HG21 ' A' ' 433' ' ' VAL . 0.0 OUTLIER -97.19 146.31 25.2 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -174.063 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -155.95 93.41 1.44 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 160.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -142.26 146.4 35.09 Favored 'General case' 0 C--N 1.281 -2.385 0 CA-C-N 114.09 -1.413 . . . . 0.0 107.539 174.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 19.4 ptmt -102.25 129.41 48.64 Favored 'General case' 0 C--N 1.282 -2.359 0 C-N-CA 118.665 -1.214 . . . . 0.0 110.185 175.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.448 HG21 ' HB2' ' A' ' 402' ' ' TRP . 8.0 p -83.56 1.15 43.46 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.086 0.946 . . . . 0.0 111.435 -175.758 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.08 -30.12 71.21 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.687 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 443' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 440' ' ' LYS . 27.0 pt20 -101.29 17.22 23.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.627 -176.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -95.94 141.84 23.73 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.257 177.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.85 163.04 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.187 1.925 . . . . 0.0 109.74 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . 0.308 2.7 pp0? -97.55 -7.78 30.54 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 14.0 mptt -127.88 113.77 16.33 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.786 0.834 . . . . 0.0 109.67 169.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 448' ' ' LEU . . . . . 0.551 ' HB2' HD12 ' A' ' 406' ' ' LEU . 50.3 mt -103.38 147.12 27.5 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 46.5 mm -99.35 122.52 51.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 120.887 0.375 . . . . 0.0 110.543 -174.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.424 ' SD ' HD23 ' A' ' 513' ' ' LEU . 57.9 ttp -112.08 121.82 46.04 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 451' ' ' GLN . . . . . 0.454 ' HB2' ' SG ' ' A' ' 497' ' ' CYS . 12.4 mm-40 -106.91 133.62 51.29 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 489' ' ' ILE . 88.1 mt -91.29 115.87 28.37 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.473 0.654 . . . . 0.0 111.391 -177.076 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.448 ' HA ' HD11 ' A' ' 544' ' ' LEU . 39.6 pt -116.9 161.76 30.79 Favored Pre-proline 0 C--N 1.311 -1.077 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.078 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' PRO . . . . . 0.451 ' HD3' HD11 ' A' ' 544' ' ' LEU . 8.4 Cg_exo -71.54 129.68 16.09 Favored 'Trans proline' 0 C--O 1.244 0.806 0 C-N-CA 121.464 1.443 . . . . 0.0 110.919 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -62.75 -28.15 69.77 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.5 0.72 . . . . 0.0 111.148 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLN . . . . . 0.41 ' CD ' ' H ' ' A' ' 456' ' ' GLN . 19.3 mp0 -63.89 -40.7 97.13 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.132 -176.906 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.8 mt -77.81 -11.47 59.89 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.198 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.1 tp -82.69 -19.33 38.32 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.0 m -58.28 -28.55 65.06 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 122.959 0.503 . . . . 0.0 111.134 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 15.7 m -61.37 -27.62 68.65 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.195 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.07 8.42 37.86 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.628 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 462' ' ' GLY . . . . . 0.426 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -45.96 -52.25 10.08 Favored Glycine 0 CA--C 1.545 1.933 0 N-CA-C 114.891 0.716 . . . . 0.0 114.891 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 463' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 11.8 Cg_endo -56.14 -28.62 71.3 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.88 2.387 . . . . 0.0 113.405 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 42.4 tp -75.93 -29.89 58.53 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.202 0.525 . . . . 0.0 110.762 -177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -72.99 -12.61 61.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.183 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -68.83 -20.48 64.31 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.777 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -127.21 84.66 2.28 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.334 0.588 . . . . 0.0 109.482 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.4 m -158.15 170.32 22.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 -178.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -110.45 143.75 40.28 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 124.326 1.051 . . . . 0.0 109.61 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.635 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 32.2 mmm -96.39 152.06 18.95 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -165.522 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 433' ' ' VAL . 4.8 m -142.27 162.08 19.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -133.84 130.03 37.32 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -110.95 117.62 33.87 Favored 'General case' 0 C--O 1.274 2.389 0 CA-C-O 121.734 0.778 . . . . 0.0 111.015 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -114.51 122.71 47.4 Favored 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 173.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -90.78 150.48 21.58 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.66 -177.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 77.4 p -82.64 138.64 34.1 Favored 'General case' 0 N--CA 1.418 -2.07 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -76.44 47.9 0.51 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.283 1.04 . . . . 0.0 109.955 177.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -81.85 -40.37 22.55 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.118 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -135.19 90.77 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 79.1 mt -67.4 -24.27 65.65 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -69.53 -42.33 74.79 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.275 0.559 . . . . 0.0 110.865 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' SER . . . . . 0.484 ' HB3' HD21 ' A' ' 427' ' ' LEU . 8.5 t -72.22 -38.35 69.0 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.76 -43.78 97.89 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.276 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -55.04 -43.04 73.4 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.312 0.645 . . . . 0.0 110.587 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.499 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.96 -46.44 59.49 Favored Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 42.4 tp -58.41 -44.3 88.96 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 123.544 0.737 . . . . 0.0 111.267 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -60.35 -40.33 90.34 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 122.654 0.382 . . . . 0.0 111.16 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -66.58 -44.04 83.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.018 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 452' ' ' LEU . 66.2 mt -65.78 -44.4 93.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.159 0.504 . . . . 0.0 109.834 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.4 mmt -63.87 -43.01 97.37 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.041 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.16 -15.36 69.74 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.215 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -84.72 -4.24 58.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.396 0.617 . . . . 0.0 109.891 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.56 30.42 6.54 Favored Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.104 -1.046 . . . . 0.0 113.739 177.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -103.4 161.75 13.58 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.64 0.257 . . . . 0.0 110.342 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -127.95 153.12 47.07 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -112.31 107.53 2.07 Favored Glycine 0 N--CA 1.424 -2.152 0 C-N-CA 120.203 -0.998 . . . . 0.0 112.4 -177.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 451' ' ' GLN . 17.6 p -84.44 117.32 23.57 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.13 120.41 50.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.881 0 CA-C-O 121.962 0.887 . . . . 0.0 109.303 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -112.81 143.24 44.39 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 113.145 -1.843 . . . . 0.0 107.763 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' PHE . . . . . 0.435 ' CD2' HG11 ' A' ' 508' ' ' VAL . 15.8 m-85 -98.68 126.48 38.81 Favored Pre-proline 0 C--N 1.268 -2.969 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 113.38 1.51 Allowed 'Trans proline' 0 C--O 1.244 0.819 0 C-N-CA 122.536 2.157 . . . . 0.0 112.992 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -77.45 124.32 27.73 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 9.4 t 172.32 -25.31 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.826 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -83.84 150.27 58.6 Favored Pre-proline 0 N--CA 1.428 -1.561 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 171.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -76.97 1.94 8.11 Favored 'Trans proline' 0 N--CA 1.478 0.591 0 C-N-CA 122.973 2.448 . . . . 0.0 113.179 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 49.7 t -85.06 142.96 29.19 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.426 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -89.95 92.9 9.19 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.435 HG11 ' CD2' ' A' ' 500' ' ' PHE . 4.6 t -88.35 137.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.133 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.624 ' HD2' ' O ' ' A' ' 528' ' ' TYR . 19.4 mmt180 -81.2 171.15 15.23 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.547 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 24.2 m -109.44 165.87 5.12 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.402 0 C-N-CA 117.966 -1.494 . . . . 0.0 112.077 -171.982 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.567 ' HB2' HG12 ' A' ' 526' ' ' ILE . 1.0 OUTLIER -133.01 134.42 44.42 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.118 -177.505 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 512' ' ' MET . . . . . 0.416 ' N ' HD22 ' A' ' 511' ' ' LEU . 35.0 tpp -102.46 121.36 42.19 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.011 -0.736 . . . . 0.0 109.011 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 522' ' ' PHE . 31.8 tp -106.95 125.29 50.81 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.622 0.725 . . . . 0.0 110.523 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 59.4 mt -124.28 148.83 47.12 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.237 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -100.04 124.0 44.92 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.359 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 34.8 p -93.9 110.42 22.09 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 173.261 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.8 p -68.92 -35.49 76.87 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.352 -1.294 . . . . 0.0 113.061 -175.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -72.92 -24.17 60.78 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.65 0.738 . . . . 0.0 110.327 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -105.24 -9.81 17.45 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.257 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 61.09 24.13 14.26 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.736 1.214 . . . . 0.0 111.598 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -133.0 167.65 26.17 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.687 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' A' ' 513' ' ' LEU . 24.4 m-85 -102.31 138.87 38.68 Favored 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.314 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -133.81 141.63 47.53 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' GLY . . . . . 0.403 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -152.69 159.12 28.27 Favored Glycine 0 N--CA 1.431 -1.663 0 C-N-CA 118.861 -1.637 . . . . 0.0 113.465 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.55 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.6 mp -115.6 139.96 49.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 173.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 511' ' ' LEU . 12.4 mt -97.97 107.98 43.73 Favored Pre-proline 0 C--O 1.249 1.072 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 177.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 525' ' ' LEU . 23.8 Cg_exo -72.06 133.13 20.85 Favored 'Trans proline' 0 C--O 1.294 3.301 0 C-N-CA 123.231 2.621 . . . . 0.0 112.289 171.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 528' ' ' TYR . . . . . 0.624 ' O ' ' HD2' ' A' ' 509' ' ' ARG . 70.4 m-85 -74.89 -41.3 60.02 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.571 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -84.03 91.95 7.75 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.944 0.878 . . . . 0.0 110.184 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -37.34 83.13 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 114.201 -1.363 . . . . 0.0 113.138 179.104 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 22.6 t -61.0 -47.71 85.21 Favored 'General case' 0 C--O 1.243 0.763 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -175.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.68 -36.54 37.22 Favored Glycine 0 N--CA 1.437 -1.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.818 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 537' ' ' ILE . 50.2 t80 -66.22 -47.34 74.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 88.2 t -65.24 -38.36 82.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.052 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -59.17 -38.56 80.06 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.38 0.61 . . . . 0.0 110.187 176.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -70.53 -46.3 48.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 533' ' ' PHE . 51.6 mm -67.33 -36.15 75.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -56.33 -43.19 78.8 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -59.64 -40.45 87.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.647 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 56.5 t -67.28 -46.56 83.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.066 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.5 ' O ' ' HG3' ' A' ' 545' ' ' GLU . 77.0 mt -62.71 -45.25 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-O 121.302 0.572 . . . . 0.0 109.935 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 542' ' ' THR . . . . . 0.447 ' HA ' ' OE1' ' A' ' 545' ' ' GLU . 21.8 m -63.37 -33.56 75.81 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.907 177.332 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -64.63 -44.08 91.66 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 173.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.451 HD11 ' HD3' ' A' ' 454' ' ' PRO . 96.8 mt -57.66 -35.89 71.15 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.486 0.714 . . . . 0.0 111.733 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 545' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 47.0 mt-10 -65.67 -27.5 68.41 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.079 0.552 . . . . 0.0 111.516 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -97.46 -36.71 10.25 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.406 -177.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -72.88 113.14 9.58 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 124.469 1.108 . . . . 0.0 108.96 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 38.4 m170 -56.34 -74.21 0.05 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.554 0.742 . . . . 0.0 112.206 -177.093 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -144.47 -44.73 0.25 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -154.77 136.12 14.1 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 . . . . . 0 C--N 1.294 -1.806 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 175.597 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 24.8 mmt . . . . . 0 CA--C 1.501 -0.93 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 21.1 m -86.42 80.78 8.56 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 34.1 m -102.22 179.32 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 6.1 m -69.36 -51.88 32.53 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 68.18 -52.3 0.54 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 124.796 1.238 . . . . 0.0 111.029 -177.479 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 398' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -107.61 136.77 46.81 Favored 'General case' 0 N--CA 1.415 -2.18 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 174.778 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mp -112.6 137.05 51.42 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.59 125.14 22.92 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -111.9 -64.65 1.26 Allowed 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.09 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.587 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 69.1 t90 -161.61 150.09 15.53 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -169.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.5 m -129.47 117.82 21.13 Favored 'General case' 0 C--N 1.276 -2.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.587 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -155.1 -172.39 22.73 Favored Glycine 0 N--CA 1.424 -2.15 0 C-N-CA 119.752 -1.213 . . . . 0.0 113.152 -174.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 428' ' ' PRO . 61.6 t -109.28 140.71 26.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.133 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 84.4 mt -113.26 128.14 56.38 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.594 ' HG2' HG22 ' A' ' 424' ' ' THR . 25.6 tt0 -117.21 126.08 52.2 Favored 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -126.96 147.95 50.09 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.36 0.664 . . . . 0.0 110.085 -174.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 409' ' ' GLN . . . . . 0.436 ' HA ' ' HA ' ' A' ' 424' ' ' THR . 45.5 tt0 -99.42 138.95 35.79 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.58 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 410' ' ' GLU . . . . . 0.442 ' O ' ' HD3' ' A' ' 412' ' ' PRO . 45.3 mt-10 -77.05 112.46 13.71 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 170.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -111.65 96.56 33.14 Favored Pre-proline 0 C--N 1.302 -1.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.406 -176.129 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 412' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' A' ' 410' ' ' GLU . 1.0 OUTLIER -87.94 -72.66 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.446 2.097 . . . . 0.0 109.352 172.202 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -174.79 136.9 0.57 Allowed Pre-proline 0 N--CA 1.438 -1.062 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -82.44 113.26 2.29 Favored 'Trans proline' 0 N--CA 1.441 -1.585 0 C-N-CA 121.424 1.416 . . . . 0.0 110.91 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -76.96 -24.2 52.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.582 0.706 . . . . 0.0 110.261 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 14.1 m -115.06 167.37 10.87 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 65.5 t -74.74 100.99 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -136.2 137.83 41.26 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.715 -177.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.38 -38.81 14.79 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.154 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 175.71 83.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.821 1.249 . . . . 0.0 110.178 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 8.9 m -128.79 7.39 5.64 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 171.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 422' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 422' ' ' LYS . 0.0 OUTLIER -79.5 152.48 30.19 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 175.785 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 94.4 mt -59.53 113.92 2.45 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.045 0.926 . . . . 0.0 113.04 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 424' ' ' THR . . . . . 0.594 HG22 ' HG2' ' A' ' 407' ' ' GLU . 6.8 m -100.53 134.9 42.8 Favored 'General case' 0 N--CA 1.418 -2.057 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 176.672 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -109.73 145.81 35.97 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -175.535 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 56.3 p -123.13 130.1 52.32 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 121.134 -0.226 . . . . 0.0 110.863 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' LEU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 428' ' ' PRO . 92.5 mt -130.55 125.94 21.78 Favored Pre-proline 0 C--N 1.316 -0.861 0 O-C-N 123.192 0.308 . . . . 0.0 111.094 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 428' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 427' ' ' LEU . 8.7 Cg_exo -75.84 142.34 25.29 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.043 2.496 . . . . 0.0 112.182 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 429' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 475' ' ' PHE . 23.1 p -141.13 168.57 19.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.2 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -115.7 129.53 56.51 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 104.953 -2.239 . . . . 0.0 104.953 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.8 t -122.79 123.92 69.33 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 CA-C-O 121.874 0.845 . . . . 0.0 110.274 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' TYR . . . . . 0.474 ' HB2' ' HB3' ' A' ' 472' ' ' GLN . 78.0 m-85 -118.54 161.0 20.75 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.506 HG12 HG12 ' A' ' 471' ' ' VAL . 6.2 m -121.86 140.22 46.5 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.501 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 434' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -96.07 132.96 40.9 Favored 'General case' 0 C--O 1.297 3.553 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.267 172.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -25.15 157.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 129.94 3.296 . . . . 0.0 117.385 -171.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.08 -2.43 35.34 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -172.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.537 ' HA ' ' CZ ' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -101.77 161.46 13.64 Favored 'General case' 0 N--CA 1.406 -2.648 0 CA-C-N 113.12 -1.54 . . . . 0.0 114.584 -174.822 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 51.0 t30 178.81 94.01 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 168.797 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -142.72 157.56 44.53 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.919 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -99.71 132.0 45.33 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.419 ' HA ' ' CD1' ' A' ' 444' ' ' TRP . 17.7 p -101.74 19.11 18.79 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.235 0.54 . . . . 0.0 111.965 -177.564 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -75.8 -27.53 57.98 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.511 0.672 . . . . 0.0 111.609 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -94.57 8.43 42.28 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.33 1.062 . . . . 0.0 109.855 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' TRP . . . . . 0.419 ' CD1' ' HA ' ' A' ' 441' ' ' THR . 12.7 m0 -80.18 121.1 81.46 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.468 177.055 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.98 149.47 70.46 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.55 2.167 . . . . 0.0 110.194 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -74.15 -22.53 59.4 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 123.066 0.546 . . . . 0.0 110.229 -174.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -124.35 123.84 41.08 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.555 173.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 90.2 mt -106.29 146.94 29.75 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 51.4 mm -98.53 119.12 46.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.508 ' SD ' HD23 ' A' ' 513' ' ' LEU . 54.2 ttp -113.33 129.7 56.46 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.347 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 451' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 451' ' ' GLN . 14.8 mm-40 -119.0 130.93 55.94 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.486 HD13 HG21 ' A' ' 489' ' ' ILE . 77.9 mt -84.54 123.71 30.6 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.233 -176.489 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 30.9 pt -128.61 158.03 73.24 Favored Pre-proline 0 C--N 1.305 -1.355 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.51 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -63.57 130.15 27.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 121.865 1.71 . . . . 0.0 111.312 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 458' ' ' LEU . 21.1 tm0? -62.3 -29.93 70.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.249 0.62 . . . . 0.0 111.667 -177.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -60.27 -31.08 69.89 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -79.29 -12.75 59.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.218 0.533 . . . . 0.0 111.096 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 455' ' ' GLN . 4.2 tt -73.74 -22.18 59.96 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 124.036 0.934 . . . . 0.0 110.938 -178.357 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 41.7 p -58.42 -19.72 38.64 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 14.6 t -70.76 -21.14 62.55 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.279 0.561 . . . . 0.0 110.905 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 86.4 mt -88.62 11.05 18.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.127 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.19 -58.43 5.08 Favored Glycine 0 CA--C 1.548 2.115 0 CA-C-O 119.38 -0.678 . . . . 0.0 114.469 178.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.27 -24.44 78.85 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.899 2.4 . . . . 0.0 112.693 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.0 tp -75.46 -46.44 32.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.223 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -70.69 -14.77 62.58 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -71.95 -17.13 62.1 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.813 0.339 . . . . 0.0 111.054 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -126.78 76.83 1.67 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' SER . . . . . 0.413 ' HA ' ' CE2' ' A' ' 528' ' ' TYR . 69.3 m -152.8 170.99 18.96 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.926 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.537 ' CZ ' ' HA ' ' A' ' 437' ' ' GLU . 6.5 ptp180 -111.69 144.04 41.61 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 125.889 1.676 . . . . 0.0 109.039 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' MET . . . . . . . . . . . . . 27.3 mmm -95.4 152.61 18.24 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.405 -167.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 524' ' ' GLY . 16.8 m -127.14 162.08 32.91 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.275 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 472' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 432' ' ' TYR . 7.1 tp-100 -133.51 119.95 20.19 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.406 ' HE1' HG21 ' A' ' 471' ' ' VAL . 30.4 m-85 -115.36 126.44 54.43 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-O 121.594 0.711 . . . . 0.0 111.57 -178.212 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.97 123.19 26.86 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 174.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 429' ' ' CYS . 56.4 m-85 -82.98 154.4 24.51 Favored 'General case' 0 C--N 1.294 -1.82 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.83 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 63.1 p -71.72 136.3 47.15 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.787 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -77.55 20.81 0.3 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -67.98 -50.36 56.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 0.0 111.448 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -120.07 83.19 2.01 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.602 0.715 . . . . 0.0 109.916 -175.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.51 -24.76 65.6 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.865 -1.062 . . . . 0.0 111.383 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 484' ' ' LYS . 29.3 mm-40 -71.09 -45.02 64.51 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.9 m -63.87 -37.16 86.36 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.279 0.561 . . . . 0.0 109.527 176.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.517 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 85.2 mt -64.57 -36.8 85.4 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.991 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 481' ' ' GLU . 36.9 ttpt -54.44 -44.49 72.53 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.715 0.806 . . . . 0.0 110.649 -178.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -69.3 -43.52 70.13 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.092 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.88 -42.48 97.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.897 0.479 . . . . 0.0 110.081 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' TYR . . . . . 0.517 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -58.49 -40.41 82.69 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.689 0.396 . . . . 0.0 111.351 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -67.28 -37.68 83.83 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.2 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.486 HG21 HD13 ' A' ' 452' ' ' LEU . 65.6 mt -68.24 -45.58 82.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.1 mmt -63.62 -37.31 86.84 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.529 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.31 -9.95 84.35 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.344 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -92.53 8.52 38.49 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.774 0.797 . . . . 0.0 109.943 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 91.61 29.66 11.74 Favored Glycine 0 C--O 1.245 0.804 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.889 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -109.24 157.03 19.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -128.24 160.51 31.89 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -118.15 109.1 1.74 Allowed Glycine 0 N--CA 1.421 -2.319 0 C-N-CA 120.004 -1.094 . . . . 0.0 111.461 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 19.6 p -82.39 120.55 25.58 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.6 t -102.35 120.2 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.723 0 CA-C-O 121.489 0.661 . . . . 0.0 109.411 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' HIS . . . . . 0.4 ' NE2' HG22 ' A' ' 534' ' ' VAL . 42.3 m80 -112.01 137.48 49.97 Favored 'General case' 0 N--CA 1.418 -2.044 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.783 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -98.95 114.81 65.83 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.535 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -58.3 107.57 0.34 Allowed 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.153 1.902 . . . . 0.0 108.593 175.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -77.28 115.19 16.85 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 119.249 -0.981 . . . . 0.0 111.003 -174.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 8.8 t -101.53 -22.71 14.44 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.62 175.264 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.38 152.24 60.63 Favored Pre-proline 0 N--CA 1.439 -0.979 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.163 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -81.9 -13.0 10.65 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.381 2.054 . . . . 0.0 112.166 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 24.8 t -95.56 168.74 10.5 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 -60.84 101.46 0.15 Allowed 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 124.346 1.059 . . . . 0.0 113.08 -176.12 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 33.6 t -85.62 109.13 18.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 172.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.402 ' H ' ' NE ' ' A' ' 509' ' ' ARG . 0.1 OUTLIER -56.75 150.83 15.28 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 124.268 0.98 . . . . 0.0 110.389 -175.82 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.563 ' O ' HG13 ' A' ' 526' ' ' ILE . 12.5 m -118.33 159.03 19.02 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.734 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 6.4 tt -135.35 147.11 48.99 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.119 -1.032 . . . . 0.0 112.747 -167.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 53.2 tpp -106.42 124.62 49.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -104.17 127.31 51.76 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.536 0.684 . . . . 0.0 110.354 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -130.72 148.68 52.54 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.664 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -102.37 129.13 48.75 Favored 'General case' 0 C--N 1.277 -2.548 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 176.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.7 t -104.92 110.7 23.18 Favored 'General case' 0 N--CA 1.414 -2.246 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 11.7 t -69.73 -22.43 63.38 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.165 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -62.66 -43.38 98.96 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.945 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.02 -4.75 24.18 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.306 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 59.99 30.02 19.55 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.616 1.166 . . . . 0.0 111.492 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -140.96 168.71 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.948 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.651 ' HB3' HD11 ' A' ' 513' ' ' LEU . 44.3 m-85 -96.41 139.26 32.78 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -138.05 166.51 23.92 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 123.689 0.796 . . . . 0.0 109.485 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' GLY . . . . . 0.509 ' O ' HG22 ' A' ' 471' ' ' VAL . . . 178.86 167.29 36.25 Favored Glycine 0 N--CA 1.42 -2.369 0 C-N-CA 119.135 -1.507 . . . . 0.0 111.745 178.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.451 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.1 mp -114.94 140.66 48.83 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 170.373 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.563 HG13 ' O ' ' A' ' 510' ' ' VAL . 6.7 tt -103.38 107.86 57.22 Favored Pre-proline 0 C--N 1.299 -1.599 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.568 175.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.557 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 32.5 Cg_exo -66.33 132.21 28.81 Favored 'Trans proline' 0 C--O 1.282 2.689 0 C-N-CA 123.315 2.677 . . . . 0.0 113.286 172.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 528' ' ' TYR . . . . . 0.43 ' HE1' ' CZ ' ' A' ' 469' ' ' ARG . 43.3 m-85 -72.26 -38.98 68.73 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 113.175 -1.83 . . . . 0.0 109.094 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.35 87.29 6.6 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.428 -174.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.61 -34.53 78.1 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.741 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.8 p -58.92 -46.45 87.91 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.467 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.65 -34.76 52.98 Favored Glycine 0 N--CA 1.429 -1.774 0 CA-C-N 116.292 -0.413 . . . . 0.0 113.254 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.494 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 73.5 t80 -70.54 -47.64 59.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.295 0.548 . . . . 0.0 110.556 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 534' ' ' VAL . . . . . 0.4 HG22 ' NE2' ' A' ' 499' ' ' HIS . 99.1 t -64.79 -37.82 81.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.002 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -59.54 -48.17 82.7 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.58 89.16 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.283 -0.484 . . . . 0.0 112.197 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.42 ' O ' HG13 ' A' ' 541' ' ' ILE . 39.9 mm -68.27 -22.15 27.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.619 -0.291 . . . . 0.0 111.326 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -60.58 -40.44 91.69 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.12 -0.363 . . . . 0.0 110.657 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.81 -38.02 89.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.94 -49.96 77.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.854 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 537' ' ' ILE . 81.8 mt -60.68 -45.96 96.66 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 123.18 0.592 . . . . 0.0 111.676 -178.295 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.7 t -65.93 -38.49 88.79 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.262 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -68.7 -41.4 79.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.246 176.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.85 -33.69 74.23 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.92 0.488 . . . . 0.0 110.361 -178.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -65.84 -26.59 67.73 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 111.862 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -83.83 -28.78 27.8 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 31.7 t60 73.25 156.78 0.18 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.712 2.005 . . . . 0.0 109.711 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' HIS . . . . . 0.44 ' HB2' ' CE1' ' A' ' 550' ' ' HIS . 3.4 p80 -149.51 102.48 3.19 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -96.68 -40.73 8.85 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 548' ' ' HIS . 40.0 m80 71.49 4.37 5.03 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.167 1.387 . . . . 0.0 112.339 -178.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 32.5 m80 . . . . . 0 C--N 1.309 -1.193 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 176.309 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 393' ' ' MET . . . . . 0.435 ' N ' ' HG ' ' A' ' 396' ' ' SER . 15.8 tpt . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 111.243 0.09 . . . . 0.0 111.243 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 14.5 m -67.57 -42.18 82.99 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.323 0.582 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 7.5 p -133.09 102.88 5.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-O 122.236 1.017 . . . . 0.0 109.212 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 396' ' ' SER . . . . . 0.435 ' HG ' ' N ' ' A' ' 393' ' ' MET . 39.4 m -147.58 -159.37 1.02 Allowed 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -176.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 19.7 m120 68.38 -156.44 0.19 Allowed 'General case' 0 C--O 1.254 1.312 0 O-C-N 123.799 0.687 . . . . 0.0 109.764 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.26 147.89 28.61 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-O 121.094 0.473 . . . . 0.0 111.345 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 4.3 mp -101.98 137.66 39.97 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.063 -175.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.25 115.45 7.72 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 175.236 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.66 -54.59 2.47 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.548 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 74.4 t90 -159.45 144.95 15.87 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.187 -171.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 45.7 m -130.0 120.89 25.49 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 174.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.548 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -156.48 -171.67 22.98 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -174.021 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -121.28 142.57 36.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-N 116.909 0.354 . . . . 0.0 110.148 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.665 HD13 ' SG ' ' A' ' 429' ' ' CYS . 9.8 mp -112.76 139.06 48.7 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.442 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 65.5 mt-10 -115.02 152.43 32.46 Favored 'General case' 0 C--O 1.254 1.34 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.141 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.15 164.04 31.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.972 1.709 . . . . 0.0 108.997 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -115.17 157.59 23.43 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 118.494 0.588 . . . . 0.0 111.012 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 410' ' ' GLU . . . . . 0.442 ' CD ' ' HE ' ' A' ' 425' ' ' ARG . 12.1 mm-40 -85.14 146.0 27.34 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.09 170.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp 44.48 82.22 0.24 Allowed Pre-proline 0 C--O 1.243 0.726 0 C-N-CA 126.216 1.806 . . . . 0.0 114.146 172.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -58.14 -45.73 29.8 Favored 'Trans proline' 0 C--O 1.241 0.664 0 C-N-CA 122.263 1.975 . . . . 0.0 110.48 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -137.23 100.51 9.48 Favored Pre-proline 0 N--CA 1.442 -0.855 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.254 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -75.26 148.1 33.86 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.17 1.914 . . . . 0.0 111.501 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -79.32 -19.73 49.65 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.624 0.726 . . . . 0.0 109.121 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 18.4 m -87.23 164.11 16.51 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.187 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 30.9 m -78.19 -13.52 13.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.6 0.714 . . . . 0.0 110.347 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -122.46 137.41 54.88 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -75.92 -17.18 59.86 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 123.316 0.385 . . . . 0.0 111.918 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 65.88 -69.17 0.11 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.422 1.489 . . . . 0.0 112.899 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 1.1 p -133.81 84.49 2.13 Favored 'General case' 0 N--CA 1.42 -1.948 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -86.65 79.79 8.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.468 1.128 . . . . 0.0 109.194 174.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 83.9 mt -93.66 152.73 18.79 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.536 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 8.1 m -89.68 131.79 35.49 Favored 'General case' 0 N--CA 1.413 -2.304 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' ARG . . . . . 0.442 ' HE ' ' CD ' ' A' ' 410' ' ' GLU . 40.0 mmt180 -100.68 145.29 28.62 Favored 'General case' 0 C--N 1.286 -2.168 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 174.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.442 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 57.5 p -144.48 159.76 42.22 Favored 'General case' 0 C--N 1.259 -3.357 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.208 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 427' ' ' LEU . . . . . 0.425 HD21 HD23 ' A' ' 483' ' ' LEU . 22.6 tp -146.55 117.36 4.72 Favored Pre-proline 0 N--CA 1.412 -2.367 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.51 132.29 23.42 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.61 2.207 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 429' ' ' CYS . . . . . 0.665 ' SG ' HD13 ' A' ' 406' ' ' LEU . 0.0 OUTLIER -125.8 157.73 36.78 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.011 -175.515 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -116.89 128.92 55.71 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 170.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 28.5 t -120.33 122.98 69.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.899 0 CA-C-O 122.137 0.97 . . . . 0.0 110.218 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.09 155.09 26.61 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 471' ' ' VAL . 26.2 m -122.33 140.74 45.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.405 0 C-N-CA 119.739 -0.785 . . . . 0.0 111.264 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.65 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 27.0 t-20 -95.2 132.24 40.37 Favored 'General case' 1 C--O 1.324 4.998 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.337 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -34.35 161.42 0.0 OUTLIER 'General case' 0 C--N 1.361 1.1 0 O-C-N 127.824 3.203 . . . . 0.0 116.66 -171.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 106.59 -3.01 36.61 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -174.128 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -99.65 161.9 13.34 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.601 1.16 . . . . 0.0 113.978 -174.699 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -165.25 95.66 0.67 Allowed 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 165.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -140.81 141.49 34.73 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.071 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -96.45 118.2 32.46 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.498 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 402' ' ' TRP . 43.5 p -81.21 5.19 17.76 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.784 0.802 . . . . 0.0 111.099 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -59.04 -32.0 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.907 1.283 . . . . 0.0 109.943 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 83.4 mm-40 -90.81 4.58 51.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.297 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 18.4 m0 -92.78 126.25 52.43 Favored Pre-proline 0 C--N 1.308 -1.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.855 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.19 162.93 33.7 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.303 2.002 . . . . 0.0 110.474 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -75.58 -26.31 57.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 120.836 0.35 . . . . 0.0 111.044 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -113.98 130.95 56.49 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.666 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 39.4 mt -118.84 147.83 43.52 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.206 176.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 58.3 mt -98.33 123.64 50.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 65.8 ttp -100.47 132.54 45.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -124.25 115.91 21.81 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.459 HD13 HG21 ' A' ' 489' ' ' ILE . 89.2 mt -88.55 116.25 26.66 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.328 0.585 . . . . 0.0 110.728 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.0 pt -119.87 161.66 37.02 Favored Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 125.033 1.333 . . . . 0.0 108.52 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -67.48 129.58 20.46 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 121.393 1.395 . . . . 0.0 111.008 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -62.58 -36.59 83.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 123.789 0.836 . . . . 0.0 111.566 -174.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -66.35 -20.93 66.22 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.473 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.92 -3.92 59.13 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 122.144 -0.348 . . . . 0.0 111.507 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.5 tp -82.06 -16.23 50.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.201 0.524 . . . . 0.0 110.99 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 31.4 m -57.49 -25.68 60.15 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.068 0.947 . . . . 0.0 112.805 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 16.7 p -70.55 -18.97 62.93 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.763 -0.586 . . . . 0.0 111.795 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 92.9 mt -99.75 10.54 41.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.299 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -47.88 -54.98 10.43 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-O 119.399 -0.667 . . . . 0.0 114.038 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.98 -20.19 59.1 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 122.759 2.306 . . . . 0.0 113.272 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.81 -35.65 43.86 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -69.39 -13.06 62.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.323 0.649 . . . . 0.0 112.379 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -57.57 -30.46 65.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -127.02 97.12 4.83 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' SER . . . . . 0.561 ' HB2' HD23 ' A' ' 525' ' ' LEU . 75.1 m -156.46 172.1 19.12 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 123.66 0.784 . . . . 0.0 110.013 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 437' ' ' GLU . 48.8 mtm180 -109.42 142.06 40.94 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.65 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 71.0 mmm -96.37 142.43 28.5 Favored 'General case' 0 CA--C 1.492 -1.264 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.19 -168.425 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 433' ' ' VAL . 4.9 m -131.59 153.56 38.98 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -132.08 127.04 35.24 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 24.3 m-85 -111.47 125.9 54.38 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.347 -177.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -130.04 127.77 40.6 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 172.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' PHE . . . . . 0.503 ' HB2' HD21 ' A' ' 483' ' ' LEU . 90.5 m-85 -99.22 166.04 11.41 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 478' ' ' LYS . 8.8 t -84.2 149.09 26.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -87.06 10.27 17.12 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.992 0.517 . . . . 0.0 111.342 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.407 ' HG2' ' OG1' ' A' ' 476' ' ' THR . 74.8 mmtt -63.21 -38.22 90.32 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.899 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -119.37 88.0 2.85 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.984 -0.686 . . . . 0.0 109.631 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 483' ' ' LEU . 63.4 mt -67.01 -23.99 65.97 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.329 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -61.11 -51.28 69.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.027 0.205 . . . . 0.0 110.753 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 30.2 m -64.06 -36.67 84.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.503 HD21 ' HB2' ' A' ' 475' ' ' PHE . 79.0 mt -69.1 -48.89 61.43 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.66 -45.41 73.85 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.293 1.037 . . . . 0.0 111.101 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.464 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.83 -44.92 66.76 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.57 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -62.66 -43.66 98.24 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -58.38 -42.48 87.16 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.244 0.618 . . . . 0.0 110.513 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -67.72 -44.62 77.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.96 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 485' ' ' GLY . 72.9 mt -64.44 -47.9 87.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 490' ' ' MET . . . . . 0.45 ' HB3' ' HB3' ' A' ' 515' ' ' TYR . 17.5 mmt -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.787 0.327 . . . . 0.0 111.086 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.04 -15.09 69.14 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.606 -178.305 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -85.46 2.5 44.34 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.687 0.795 . . . . 0.0 109.712 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.36 30.92 6.36 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 119.452 -1.356 . . . . 0.0 112.774 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -111.63 162.22 15.41 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 122.603 -0.351 . . . . 0.0 110.843 176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -133.73 158.84 42.28 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.48 107.17 1.32 Allowed Glycine 0 N--CA 1.422 -2.245 0 C-N-CA 119.968 -1.111 . . . . 0.0 112.074 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 38.7 t -85.91 121.52 28.66 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 176.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' VAL . . . . . 0.415 ' HB ' ' HG ' ' A' ' 511' ' ' LEU . 73.2 t -102.21 120.57 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 122.078 0.942 . . . . 0.0 109.896 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 499' ' ' HIS . . . . . 0.44 ' NE2' HG22 ' A' ' 534' ' ' VAL . 29.9 m80 -110.09 143.22 40.46 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.591 -178.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -99.03 141.73 23.39 Favored Pre-proline 0 C--N 1.266 -3.042 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -55.7 126.63 23.08 Favored 'Trans proline' 0 C--O 1.247 0.955 0 C-N-CA 121.85 1.7 . . . . 0.0 108.519 171.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' HIS . . . . . 0.432 ' NE2' ' HA ' ' A' ' 505' ' ' PRO . 10.3 t60 -76.5 116.29 17.05 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.269 0.557 . . . . 0.0 109.52 -173.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 9.9 t -134.9 -46.93 0.73 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.389 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.73 125.36 71.35 Favored Pre-proline 0 N--CA 1.443 -0.795 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 171.494 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' PRO . . . . . 0.432 ' HA ' ' NE2' ' A' ' 502' ' ' HIS . 42.0 Cg_endo -68.92 -32.74 21.6 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 121.977 1.785 . . . . 0.0 113.975 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 11.1 p -134.43 -13.36 2.33 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -91.95 10.05 30.5 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -175.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.92 143.59 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.123 0 C-N-CA 118.78 -1.168 . . . . 0.0 108.654 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 528' ' ' TYR . 6.6 mpt_? -116.45 174.37 6.1 Favored 'General case' 0 C--N 1.281 -2.413 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.9 m -126.84 164.09 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 C-N-CA 118.687 -1.205 . . . . 0.0 108.266 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.554 ' HB3' HG12 ' A' ' 526' ' ' ILE . 1.3 pp -137.74 151.02 47.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 117.111 -1.836 . . . . 0.0 111.92 -175.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' MET . . . . . 0.501 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 35.4 tpp -104.77 134.59 47.65 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 522' ' ' PHE . 58.1 tp -119.39 120.34 36.61 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 123.399 0.68 . . . . 0.0 109.994 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 62.5 mt -129.03 146.12 51.08 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.301 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.45 ' HB3' ' HB3' ' A' ' 490' ' ' MET . 33.5 t80 -99.09 123.57 43.48 Favored 'General case' 0 C--N 1.282 -2.361 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 178.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 516' ' ' SER . . . . . 0.443 ' OG ' ' HD3' ' A' ' 519' ' ' LYS . 38.3 t -99.24 111.16 23.6 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 174.557 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 40.5 m -67.83 -29.25 68.36 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.416 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -75.02 -40.41 60.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.322 0.582 . . . . 0.0 109.694 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' LYS . . . . . 0.443 ' HD3' ' OG ' ' A' ' 516' ' ' SER . 3.8 mptp? -85.83 -9.91 56.26 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.22 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.4 tptt 63.5 24.28 14.0 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.206 1.402 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.37 167.73 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.961 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 30.9 m-85 -97.09 139.02 33.71 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 56.4 ttp -138.94 148.66 43.83 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -160.55 170.82 36.6 Favored Glycine 0 N--CA 1.421 -2.34 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.589 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.561 HD23 ' HB2' ' A' ' 468' ' ' SER . 7.3 mp -115.59 139.98 49.6 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.554 HG12 ' HB3' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -103.59 108.08 58.25 Favored Pre-proline 0 C--N 1.298 -1.667 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.862 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 37.5 Cg_exo -69.07 133.6 27.26 Favored 'Trans proline' 0 C--O 1.295 3.327 0 C-N-CA 123.852 3.035 . . . . 0.0 114.504 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' TYR . . . . . 0.58 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 49.4 m-85 -65.68 -45.38 83.08 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 112.541 -2.118 . . . . 0.0 111.776 -176.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -99.51 119.09 37.47 Favored 'General case' 0 CA--C 1.491 -1.327 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.844 -173.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -66.56 -41.86 87.98 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.349 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 44.3 t -65.91 -48.07 72.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -65.57 -43.6 94.25 Favored Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 121.404 -0.427 . . . . 0.0 112.802 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.15 -47.4 57.98 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.436 -177.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' VAL . . . . . 0.44 HG22 ' NE2' ' A' ' 499' ' ' HIS . 93.7 t -64.62 -38.98 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 110.601 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -61.49 -36.78 81.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.284 0.564 . . . . 0.0 110.172 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.93 -46.4 37.18 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.018 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 31.4 mm -64.25 -28.15 44.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.423 0.689 . . . . 0.0 111.521 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -55.55 -39.37 70.53 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 122.887 0.475 . . . . 0.0 110.626 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -65.35 -40.98 94.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 43.1 t -63.4 -42.63 96.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.553 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.1 -46.31 96.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 38.9 m -61.59 -42.18 98.5 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.71 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -64.39 -43.41 94.52 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.5 tp -56.5 -47.96 78.2 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 110.537 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -62.76 -36.53 83.38 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.239 178.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -72.64 -33.8 66.87 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -58.91 -48.47 81.32 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 58.91 77.07 0.32 Allowed 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 124.673 1.233 . . . . 0.0 109.069 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -73.09 118.19 15.74 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.421 -176.462 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 4.4 p80 63.47 166.07 0.13 Allowed 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.921 2.088 . . . . 0.0 112.733 -177.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--N 1.294 -1.807 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 171.81 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 25.7 ptt? . . . . . 0 CA--C 1.511 -0.54 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 15.8 p -75.7 156.94 34.25 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 13.6 p -79.1 72.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-O 123.054 1.407 . . . . 0.0 111.675 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 19.6 m -98.73 30.63 3.23 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.475 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -97.08 137.1 36.66 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.73 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.24 132.37 54.39 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.313 0.577 . . . . 0.0 110.29 172.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 399' ' ' LEU . . . . . 0.545 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.0 mp -95.05 132.62 39.74 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.857 -172.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.09 118.83 15.45 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.87 -52.72 2.77 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -172.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.492 ' HB2' HG21 ' A' ' 441' ' ' THR . 65.2 t90 -154.57 149.89 27.15 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.266 -171.722 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 22.8 t -131.81 130.05 41.28 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.461 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -162.33 -172.79 30.22 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -177.388 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.1 t -113.22 139.29 39.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 426' ' ' SER . 72.8 mt -113.92 140.96 47.95 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.64 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 58.5 mt-10 -115.37 126.28 54.23 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 58.6 p-90 -123.03 130.87 53.35 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -173.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -128.49 145.87 50.98 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 114.528 -1.214 . . . . 0.0 111.21 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 410' ' ' GLU . . . . . 0.513 ' CB ' ' HB2' ' A' ' 452' ' ' LEU . 15.9 tt0 166.74 -69.71 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 127.534 2.333 . . . . 0.0 106.002 171.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -119.27 88.88 38.7 Favored Pre-proline 0 N--CA 1.436 -1.126 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.889 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.42 80.34 3.1 Favored 'Trans proline' 0 N--CA 1.429 -2.272 0 N-CA-C 106.157 -2.286 . . . . 0.0 106.157 168.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -72.69 142.95 84.18 Favored Pre-proline 0 N--CA 1.434 -1.231 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.854 -173.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 414' ' ' PRO . . . . . 0.531 ' HA ' ' OD2' ' A' ' 418' ' ' ASP . 9.9 Cg_endo -53.01 120.56 7.87 Favored 'Trans proline' 0 C--O 1.255 1.328 0 C-N-CA 122.623 2.215 . . . . 0.0 110.321 173.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -99.8 -34.93 9.96 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.046 0.451 . . . . 0.0 110.574 -177.08 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 61.2 m -156.04 -74.62 0.1 Allowed 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 46.7 t -133.02 85.14 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 121.236 0.541 . . . . 0.0 110.256 -177.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 418' ' ' ASP . . . . . 0.531 ' OD2' ' HA ' ' A' ' 414' ' ' PRO . 12.5 p-10 -137.91 118.46 13.91 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.864 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.7 -33.83 17.4 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.86 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -81.44 153.24 27.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.476 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 23.7 m -103.82 -30.98 10.03 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.71 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -90.72 89.19 7.4 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 119.082 -1.047 . . . . 0.0 112.075 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.56 143.01 39.84 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.287 175.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 5.6 m -100.58 120.11 39.54 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.29 -1.745 . . . . 0.0 106.29 175.516 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 425' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 16.2 mmm180 -103.56 145.11 30.52 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.64 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 33.8 p -141.86 138.44 32.13 Favored 'General case' 0 N--CA 1.414 -2.254 0 O-C-N 123.459 0.475 . . . . 0.0 110.495 -175.263 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 96.8 mt -137.25 118.15 10.78 Favored Pre-proline 0 C--N 1.293 -1.883 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.695 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.27 138.62 56.55 Favored 'Trans proline' 0 C--O 1.249 1.056 0 C-N-CA 122.7 2.267 . . . . 0.0 109.542 170.178 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 429' ' ' CYS . . . . . 0.506 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 12.5 p -144.98 165.42 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -175.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -116.45 133.25 56.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.9 t -121.45 124.16 71.22 Favored 'Isoleucine or valine' 0 C--O 1.259 1.564 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.459 -174.383 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -105.25 160.81 14.81 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 175.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 471' ' ' VAL . 15.5 m -121.97 140.57 45.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 175.581 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.538 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 27.1 t-20 -96.16 132.18 41.85 Favored 'General case' 1 C--O 1.316 4.565 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.28 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.545 ' CD2' HD11 ' A' ' 399' ' ' LEU . 77.0 m-70 -33.0 160.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 O-C-N 128.305 3.503 . . . . 0.0 116.438 -170.372 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.74 -1.27 30.44 Favored Glycine 0 CA--C 1.497 -1.06 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.48 161.66 13.49 Favored 'General case' 0 C--N 1.289 -2.039 0 C-N-CA 126.194 1.798 . . . . 0.0 115.121 -172.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -159.36 98.88 1.44 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 168.418 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 439' ' ' LEU . . . . . 0.403 HD12 ' CZ2' ' A' ' 444' ' ' TRP . 1.9 pt? -139.19 139.38 37.5 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.732 -0.605 . . . . 0.0 112.163 -175.506 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -103.07 106.6 17.15 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 402' ' ' TRP . 25.2 p -80.28 -2.79 46.67 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 122.215 1.007 . . . . 0.0 112.435 -175.337 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.13 -14.22 60.94 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.225 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -101.45 9.61 41.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.782 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' TRP . . . . . 0.403 ' CZ2' HD12 ' A' ' 439' ' ' LEU . 33.7 m0 -99.08 140.64 21.85 Favored Pre-proline 0 C--O 1.247 0.945 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.368 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.64 153.99 64.54 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.877 1.718 . . . . 0.0 109.816 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -81.0 -5.16 57.25 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 92.3 mttt -132.21 126.21 33.0 Favored 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.341 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 448' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 500' ' ' PHE . 73.5 mt -118.6 146.99 44.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 63.4 mt -105.02 125.97 59.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.501 -177.433 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.408 ' HB2' HG22 ' A' ' 498' ' ' VAL . 48.5 ttp -106.79 118.02 35.58 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.426 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -99.86 127.04 46.06 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 175.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' LEU . . . . . 0.55 HD13 HG21 ' A' ' 489' ' ' ILE . 29.6 mt -86.67 136.79 32.9 Favored 'General case' 0 C--N 1.28 -2.413 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.31 161.27 60.14 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.83 129.09 16.92 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.348 1.366 . . . . 0.0 111.234 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -63.37 -25.13 68.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.916 0.886 . . . . 0.0 111.77 -177.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -58.76 -37.04 75.37 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 120.851 0.358 . . . . 0.0 110.976 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 7.7 mp -83.3 3.21 32.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.298 0.57 . . . . 0.0 111.42 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.95 -16.45 61.53 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.882 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 18.8 p -58.74 -30.62 67.62 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.854 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 7.5 m -71.27 -18.81 62.41 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.538 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.02 5.28 38.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 122.106 -0.371 . . . . 0.0 111.806 -175.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.3 -55.44 3.04 Favored Glycine 0 CA--C 1.559 2.781 0 CA-C-N 114.854 -1.067 . . . . 0.0 115.304 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.23 -26.43 76.5 Favored 'Trans proline' 0 C--N 1.368 1.588 0 C-N-CA 123.405 2.737 . . . . 0.0 114.011 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.77 -46.12 66.51 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -72.64 -14.72 61.66 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.215 -178.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -70.47 -24.77 62.92 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.357 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -122.2 85.04 2.35 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' SER . . . . . 0.439 ' HB2' HD23 ' A' ' 525' ' ' LEU . 53.2 m -151.73 163.04 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.639 0.733 . . . . 0.0 112.657 -175.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.37 142.91 41.4 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 126.28 1.832 . . . . 0.0 106.458 177.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.538 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 1.9 mmm -96.66 151.33 19.73 Favored 'General case' 0 CA--C 1.487 -1.447 0 C-N-CA 118.439 -1.305 . . . . 0.0 110.976 -168.207 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 433' ' ' VAL . 35.9 m -135.21 154.34 35.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 C-N-CA 123.695 0.798 . . . . 0.0 109.239 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -134.14 123.64 24.74 Favored 'General case' 0 C--N 1.285 -2.215 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.455 ' CE2' HD11 ' A' ' 406' ' ' LEU . 25.6 m-85 -107.91 133.4 52.3 Favored 'General case' 0 C--O 1.278 2.564 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.901 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -131.03 123.63 29.13 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 172.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' PHE . . . . . 0.506 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 98.4 m-85 -93.25 166.01 12.52 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 123.091 0.244 . . . . 0.0 110.545 -177.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 9.9 t -81.84 137.56 35.24 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.25 37.17 0.76 Allowed 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.092 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -78.95 -52.93 7.59 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.096 0.474 . . . . 0.0 111.001 177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -103.9 78.22 1.52 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.987 0.899 . . . . 0.0 108.65 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.84 -22.32 66.58 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.321 -1.309 . . . . 0.0 113.478 -175.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -69.52 -36.94 76.88 Favored 'General case' 0 C--N 1.31 -1.138 0 O-C-N 122.963 0.164 . . . . 0.0 111.248 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 66.6 m -67.42 -40.04 85.52 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.632 174.331 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.411 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 3.7 mm? -63.76 -45.93 87.59 Favored 'General case' 0 C--O 1.206 -1.214 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.739 176.62 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -55.21 -45.68 75.91 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.811 0.444 . . . . 0.0 110.611 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.414 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.44 -44.23 74.38 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.033 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -63.72 -43.81 95.45 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.438 0.695 . . . . 0.0 109.883 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 10.3 m-85 -56.91 -42.52 80.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.961 0.504 . . . . 0.0 111.053 177.281 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 488' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 492' ' ' ASN . 55.5 mtp180 -67.26 -44.57 79.05 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.816 178.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.55 HG21 HD13 ' A' ' 452' ' ' LEU . 75.4 mt -61.04 -48.18 90.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 O-C-N 123.396 0.435 . . . . 0.0 110.688 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 20.7 mmt -63.64 -46.63 84.78 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -68.5 -20.61 73.87 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.408 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 488' ' ' ARG . 4.0 t30 -80.78 0.24 35.65 Favored 'General case' 0 C--O 1.245 0.866 0 CA-C-O 121.551 0.691 . . . . 0.0 110.197 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.99 31.09 6.4 Favored Glycine 0 N--CA 1.439 -1.128 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.384 177.592 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -109.88 162.22 14.7 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 122.36 -0.494 . . . . 0.0 110.396 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -135.93 150.17 49.2 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -111.63 111.72 2.97 Favored Glycine 0 N--CA 1.43 -1.731 0 C-N-CA 119.482 -1.342 . . . . 0.0 113.031 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.06 115.55 22.94 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 176.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' VAL . . . . . 0.408 HG22 ' HB2' ' A' ' 450' ' ' MET . 47.6 t -101.48 120.85 51.65 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 CA-C-O 121.575 0.702 . . . . 0.0 109.535 -175.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -111.5 139.82 46.61 Favored 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.086 -1.416 . . . . 0.0 110.508 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' PHE . . . . . 0.411 ' HA ' HD22 ' A' ' 448' ' ' LEU . 2.4 m-85 -102.21 133.43 20.62 Favored Pre-proline 0 C--N 1.292 -1.894 0 CA-C-N 113.915 -1.493 . . . . 0.0 108.761 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -57.92 141.75 96.16 Favored 'Trans proline' 0 C--O 1.255 1.345 0 N-CA-C 107.815 -1.648 . . . . 0.0 107.815 167.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -75.38 116.44 16.11 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.934 0.873 . . . . 0.0 110.632 -171.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 19.0 m -130.08 -42.86 1.21 Allowed 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.482 -177.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -85.11 118.9 71.81 Favored Pre-proline 0 C--O 1.24 0.587 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.72 175.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -68.62 -28.92 30.78 Favored 'Trans proline' 0 N--CA 1.48 0.683 0 C-N-CA 122.93 2.42 . . . . 0.0 111.217 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 48.6 t -83.32 36.36 0.52 Allowed 'General case' 0 C--O 1.25 1.099 0 C-N-CA 123.605 0.762 . . . . 0.0 109.311 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 67.58 110.9 0.04 OUTLIER 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 111.841 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 13.9 p -70.62 -27.48 31.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.255 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 31.8 mtt180 73.42 169.07 0.31 Allowed 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.249 1.42 . . . . 0.0 109.614 175.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.544 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 16.0 m -131.1 163.91 35.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.903 -174.411 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.505 ' HB3' HG12 ' A' ' 526' ' ' ILE . 3.3 pp -138.33 154.96 48.98 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 118.068 -1.453 . . . . 0.0 110.541 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 41.3 ttm -117.25 130.1 56.34 Favored 'General case' 0 C--N 1.295 -1.772 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.534 173.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 522' ' ' PHE . 34.9 tp -95.63 129.78 42.72 Favored 'General case' 0 N--CA 1.411 -2.404 0 O-C-N 124.018 0.824 . . . . 0.0 108.991 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 64.4 mt -133.02 148.84 52.23 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.326 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -100.05 121.9 42.09 Favored 'General case' 0 C--N 1.271 -2.822 0 O-C-N 122.233 -0.292 . . . . 0.0 110.477 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 37.9 t -95.23 109.43 21.54 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.0 m -68.81 -35.41 76.96 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.733 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -69.6 -31.34 69.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.276 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -97.59 -9.99 25.97 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.842 0.353 . . . . 0.0 110.4 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 59.57 35.89 22.68 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 124.35 1.06 . . . . 0.0 111.413 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -143.01 167.5 14.07 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB3' HD11 ' A' ' 513' ' ' LEU . 52.5 m-85 -98.83 138.57 35.78 Favored 'General case' 0 N--CA 1.413 -2.305 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.901 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.4 ptm -127.06 165.88 18.65 Favored 'General case' 0 C--N 1.284 -2.274 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.19 150.88 15.34 Favored Glycine 0 N--CA 1.41 -3.047 0 C-N-CA 119.054 -1.546 . . . . 0.0 112.055 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.479 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.8 mp -114.29 140.24 48.76 Favored 'General case' 0 C--N 1.273 -2.743 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.505 HG12 ' HB3' ' A' ' 511' ' ' LEU . 7.3 mt -99.24 108.05 47.89 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 123.793 0.683 . . . . 0.0 110.812 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 34.2 Cg_exo -68.69 131.2 22.23 Favored 'Trans proline' 0 C--O 1.295 3.348 0 C-N-CA 122.102 1.868 . . . . 0.0 110.963 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -74.63 -41.57 60.14 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.389 -1.732 . . . . 0.0 110.27 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -73.85 84.89 1.7 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.995 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -66.37 -43.79 84.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.127 -179.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 15.2 m -61.34 -44.0 97.92 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.31 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -68.56 -44.86 70.09 Favored Glycine 0 C--O 1.243 0.713 0 C-N-CA 121.171 -0.537 . . . . 0.0 112.866 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.495 ' CE2' HG13 ' A' ' 537' ' ' ILE . 67.6 t80 -67.4 -48.27 67.85 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 122.126 0.17 . . . . 0.0 111.117 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.2 -37.94 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 O-C-N 123.187 0.304 . . . . 0.0 110.567 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -58.2 -46.91 84.99 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.039 0.447 . . . . 0.0 110.383 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.95 -43.38 49.65 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.706 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 541' ' ' ILE . 32.8 mm -62.03 -36.24 73.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 122.383 0.273 . . . . 0.0 111.56 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -60.65 -35.4 76.1 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.202 0.525 . . . . 0.0 110.672 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.07 -37.71 75.55 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.31 -37.94 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.642 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.55 HG12 ' O ' ' A' ' 537' ' ' ILE . 43.8 mm -60.39 -45.68 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 92.4 m -59.68 -42.93 94.03 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.658 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -67.43 -37.29 82.81 Favored 'General case' 0 C--O 1.203 -1.39 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.558 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 541' ' ' ILE . 51.9 tp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 124.197 0.999 . . . . 0.0 111.372 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 545' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 46.7 mt-10 -65.39 -38.81 91.1 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.99 -178.801 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -83.09 -40.95 19.17 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.251 -177.138 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -117.86 105.17 11.66 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.0 0.429 . . . . 0.0 111.354 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -95.29 44.47 1.09 Allowed 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -121.61 132.2 54.54 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -123.17 11.01 9.41 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 170.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 N--CA 1.424 -1.773 0 CA-C-N 112.46 -2.154 . . . . 0.0 105.591 -179.952 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 90.2 mtp . . . . . 0 CA--C 1.495 -1.137 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 17.0 t 63.48 41.12 7.71 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 124.032 0.833 . . . . 0.0 110.321 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.75 -14.4 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.135 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 15.0 m -86.59 -29.28 22.72 Favored 'General case' 0 N--CA 1.441 -0.913 0 O-C-N 121.506 -0.746 . . . . 0.0 109.644 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -76.8 -44.18 33.66 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.222 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 398' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -149.96 135.18 18.05 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.507 0.67 . . . . 0.0 112.375 -179.338 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 399' ' ' LEU . . . . . 0.475 HD11 ' ND1' ' A' ' 435' ' ' HIS . 3.2 mp -115.25 137.47 52.0 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 171.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.46 121.7 17.51 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.39 -57.08 2.13 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.503 ' HB2' HG21 ' A' ' 441' ' ' THR . 61.2 t90 -153.37 145.36 23.66 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 120.895 0.379 . . . . 0.0 111.188 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 25.0 p -119.72 126.91 52.22 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.313 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.45 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -165.47 -172.23 32.64 Favored Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.328 -176.351 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 59.5 t -113.19 135.54 52.37 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -177.474 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 448' ' ' LEU . 15.7 tp -113.94 136.81 52.48 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.481 ' HG2' ' CB ' ' A' ' 426' ' ' SER . 51.6 mt-10 -114.54 133.87 55.46 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -178.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 51.1 p-90 -127.39 142.08 51.52 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 409' ' ' GLN . . . . . 0.489 ' HB2' ' OE1' ' A' ' 451' ' ' GLN . 21.2 mt-30 -140.05 152.67 46.39 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.188 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.9 -56.71 2.42 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.522 174.774 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? 42.68 83.73 0.2 Allowed Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.7 -39.73 8.39 Favored 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 121.574 1.516 . . . . 0.0 110.456 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -104.01 139.92 20.57 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.78 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -43.86 -59.46 1.06 Allowed 'Trans proline' 0 C--N 1.361 1.233 0 C-N-CA 124.624 3.549 . . . . 0.0 114.582 -175.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -101.27 -25.6 13.93 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.058 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.6 m 68.05 -82.14 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.469 1.108 . . . . 0.0 108.752 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 96.4 t -145.56 -68.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.759 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -136.55 137.81 40.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.419 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.08 78.02 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -176.444 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -83.13 -15.4 50.86 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.225 0.535 . . . . 0.0 110.562 -174.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 26.9 m -75.03 -26.17 59.27 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.918 0.866 . . . . 0.0 109.818 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 46.7 mttm -98.71 91.78 5.27 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.177 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 92.0 mt -73.07 116.8 14.03 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.843 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 424' ' ' THR . . . . . 0.481 HG23 ' HG3' ' A' ' 409' ' ' GLN . 19.9 m -63.49 137.63 58.21 Favored 'General case' 0 N--CA 1.409 -2.496 0 CA-C-N 114.448 -1.251 . . . . 0.0 108.514 177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 42.4 mmt180 -90.1 144.15 26.14 Favored 'General case' 0 N--CA 1.411 -2.405 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.481 ' CB ' ' HG2' ' A' ' 407' ' ' GLU . 1.0 OUTLIER -137.85 130.14 29.17 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -177.315 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 90.3 mt -131.47 126.73 21.34 Favored Pre-proline 0 C--N 1.294 -1.809 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -60.23 138.71 83.06 Favored 'Trans proline' 0 C--O 1.249 1.03 0 C-N-CA 122.286 1.991 . . . . 0.0 110.742 172.358 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.6 p -145.95 157.4 43.89 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.038 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -117.36 129.37 55.83 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 46.5 t -113.67 124.2 70.08 Favored 'Isoleucine or valine' 0 C--O 1.257 1.469 0 CA-C-O 121.732 0.777 . . . . 0.0 111.129 -173.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.54 161.34 15.15 Favored 'General case' 0 C--N 1.28 -2.415 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.321 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 471' ' ' VAL . 6.1 m -119.79 140.71 42.92 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 174.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.633 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 26.8 t-20 -94.06 130.13 40.32 Favored 'General case' 1 C--O 1.339 5.809 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 171.713 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.475 ' ND1' HD11 ' A' ' 399' ' ' LEU . 0.5 OUTLIER -47.53 165.05 0.03 OUTLIER 'General case' 0 C--N 1.357 0.893 0 O-C-N 128.931 3.894 . . . . 0.0 115.372 -162.385 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 436' ' ' GLY . . . . . 0.449 ' H ' ' CD2' ' A' ' 435' ' ' HIS . . . 110.14 -2.98 29.88 Favored Glycine 0 N--CA 1.423 -2.168 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -172.146 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -132.38 159.59 38.79 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.558 -174.403 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -152.57 98.67 2.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 170.728 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 439' ' ' LEU . . . . . 0.542 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -118.82 158.53 25.45 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.947 0.403 . . . . 0.0 111.91 -177.846 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -102.14 118.13 36.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.503 HG21 ' HB2' ' A' ' 402' ' ' TRP . 20.2 p -95.97 8.0 44.85 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.346 1.069 . . . . 0.0 109.626 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.81 -22.84 66.59 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.205 -1.362 . . . . 0.0 111.412 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -107.47 17.27 22.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.036 0.446 . . . . 0.0 111.532 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -91.17 136.03 27.7 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.433 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -64.43 158.75 47.65 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.156 1.904 . . . . 0.0 109.469 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.02 -7.09 59.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.123 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 88.8 mttt -128.5 130.38 47.41 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 122.756 0.422 . . . . 0.0 110.59 176.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 448' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 406' ' ' LEU . 83.8 mt -119.16 147.27 44.38 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 43.9 mm -99.22 120.54 48.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.462 ' SD ' HD23 ' A' ' 513' ' ' LEU . 56.2 ttp -111.96 119.28 37.96 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.067 0.46 . . . . 0.0 111.333 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 451' ' ' GLN . . . . . 0.489 ' OE1' ' HB2' ' A' ' 409' ' ' GLN . 14.7 mm100 -104.9 133.16 50.17 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 176.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.02 122.09 29.56 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 120.969 0.414 . . . . 0.0 111.0 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 pt -129.77 157.81 75.58 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.676 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.41 129.34 29.3 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 121.832 1.688 . . . . 0.0 113.134 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.2 tt0 -63.74 -25.46 68.21 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.197 0.999 . . . . 0.0 111.57 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -57.62 -41.49 81.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.584 0.753 . . . . 0.0 111.742 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.04 5.58 21.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.133 -172.259 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.97 -27.21 36.09 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.599 -178.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -31.43 67.08 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -174.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.7 m -72.46 -17.85 61.73 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.364 0.666 . . . . 0.0 112.439 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 10.8 tp -85.6 11.12 11.41 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.304 0.642 . . . . 0.0 111.318 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -37.6 -54.54 1.77 Allowed Glycine 0 CA--C 1.545 1.966 0 N-CA-C 116.667 1.427 . . . . 0.0 116.667 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.21 -40.67 51.54 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 123.07 2.513 . . . . 0.0 113.424 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.76 -30.45 70.67 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.201 0.524 . . . . 0.0 111.355 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -78.07 -13.11 59.99 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.444 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -74.78 -43.33 55.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.621 175.81 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' ASN . . . . . 0.401 ' O ' ' HA ' ' A' ' 527' ' ' PRO . 9.8 p-10 -95.54 74.2 3.24 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 122.025 0.917 . . . . 0.0 110.057 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -142.32 169.85 16.81 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.95 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.542 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 14.3 ptp180 -139.63 143.79 37.37 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 127.529 2.332 . . . . 0.0 105.724 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.633 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 62.1 mtp -97.23 153.12 18.22 Favored 'General case' 0 CA--C 1.483 -1.599 0 C-N-CA 115.982 -2.287 . . . . 0.0 111.875 -167.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 433' ' ' VAL . 34.8 m -133.03 159.76 42.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.993 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -134.28 121.39 21.21 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 14.1 m-85 -107.3 117.65 34.65 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.198 -177.27 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -111.87 122.27 47.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -93.81 160.57 14.69 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.532 -176.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' THR . . . . . 0.472 ' O ' HD11 ' A' ' 483' ' ' LEU . 10.1 t -66.35 138.29 57.5 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 123.73 0.644 . . . . 0.0 109.532 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -98.6 26.86 5.22 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -60.25 -52.03 67.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.188 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -128.23 104.18 7.6 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.548 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.96 -23.0 65.91 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.346 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -69.91 -41.5 74.58 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 120.809 0.337 . . . . 0.0 111.211 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 35.7 m -63.67 -35.31 80.12 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.749 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.472 HD11 ' O ' ' A' ' 476' ' ' THR . 93.5 mt -73.03 -51.41 18.26 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.04 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -55.33 -36.77 66.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.193 0.597 . . . . 0.0 111.628 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -60.51 -50.83 63.26 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.02 -42.8 89.15 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 123.251 0.62 . . . . 0.0 110.772 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -58.26 -45.51 87.69 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.18 0.592 . . . . 0.0 110.295 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -65.41 -38.57 90.35 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.391 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 485' ' ' GLY . 80.4 mt -68.21 -50.38 58.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.988 0.423 . . . . 0.0 110.572 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 490' ' ' MET . . . . . 0.488 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 91.8 mtp -70.72 -35.79 72.89 Favored 'General case' 0 C--N 1.312 -1.039 0 O-C-N 122.134 -0.354 . . . . 0.0 111.592 -176.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.76 -18.66 70.56 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -81.92 6.84 14.61 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.869 0.842 . . . . 0.0 110.107 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.35 29.73 6.94 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.529 -0.843 . . . . 0.0 113.015 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -112.45 158.67 19.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -129.28 160.14 33.92 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -115.1 115.81 3.55 Favored Glycine 0 N--CA 1.417 -2.599 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.6 t -92.74 118.89 31.55 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 498' ' ' VAL . . . . . 0.446 HG22 ' HB2' ' A' ' 450' ' ' MET . 78.0 t -101.66 120.78 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 CA-C-O 121.361 0.6 . . . . 0.0 110.151 -178.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 499' ' ' HIS . . . . . 0.505 ' NE2' HG22 ' A' ' 534' ' ' VAL . 27.1 m80 -109.36 140.46 43.02 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.41 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -104.06 125.89 33.21 Favored Pre-proline 0 C--N 1.292 -1.934 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.535 -175.339 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.29 107.06 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 121.902 1.735 . . . . 0.0 108.351 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -91.23 117.47 29.66 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -172.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 13.1 p -76.43 -58.68 3.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.432 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.28 122.83 75.55 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.236 173.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -81.11 2.24 8.72 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.34 2.027 . . . . 0.0 112.412 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.3 -69.66 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.241 0.616 . . . . 0.0 110.1 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -169.91 108.35 0.38 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.571 0.7 . . . . 0.0 111.474 174.356 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 32.3 t -100.95 -16.82 7.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 169.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 20.4 mtm-85 72.82 177.08 0.26 Allowed 'General case' 0 C--N 1.371 1.51 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.274 177.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 5.6 m -133.83 162.33 39.58 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.664 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 526' ' ' ILE . 0.9 OUTLIER -134.19 136.52 43.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.08 0.854 . . . . 0.0 113.172 -171.429 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 512' ' ' MET . . . . . 0.454 ' N ' HD22 ' A' ' 511' ' ' LEU . 49.1 tpp -101.83 118.83 37.74 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.239 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 522' ' ' PHE . 24.2 tp -105.14 126.62 52.28 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.531 0.681 . . . . 0.0 110.183 -177.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 79.6 mt -123.97 135.04 53.38 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.184 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -89.61 123.44 33.68 Favored 'General case' 0 C--N 1.285 -2.212 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.335 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.3 t -98.72 110.19 22.83 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 31.7 m -68.33 -27.25 66.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.494 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.17 -44.13 96.29 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.422 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -103.79 1.09 31.2 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.821 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . 0.421 0.0 OUTLIER 49.15 34.92 6.44 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.11 2.164 . . . . 0.0 114.421 -176.352 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -137.62 167.83 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.802 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.095 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 70.0 m-85 -98.19 136.79 37.9 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.233 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -119.56 145.91 45.96 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -156.23 154.12 25.27 Favored Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 118.285 -1.912 . . . . 0.0 113.516 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.516 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 10.6 mp -115.37 135.02 54.56 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 171.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.53 HG12 HD23 ' A' ' 511' ' ' LEU . 16.5 mt -101.36 107.45 50.84 Favored Pre-proline 0 N--CA 1.439 -0.983 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.568 ' HG2' ' CD2' ' A' ' 533' ' ' PHE . 35.9 Cg_exo -72.19 138.46 30.62 Favored 'Trans proline' 0 C--O 1.292 3.179 0 C-N-CA 122.994 2.463 . . . . 0.0 111.944 170.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -77.07 -43.07 35.74 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.302 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.41 92.25 4.57 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.64 0.734 . . . . 0.0 110.156 -176.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . 0.253 0.0 OUTLIER -67.21 -31.08 71.21 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 114.959 -1.018 . . . . 0.0 113.569 -179.367 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.3 m -62.83 -47.55 82.9 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -176.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.98 -34.69 52.07 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.229 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.568 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 49.9 t80 -68.36 -48.08 65.73 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 534' ' ' VAL . . . . . 0.505 HG22 ' NE2' ' A' ' 499' ' ' HIS . 95.2 t -64.44 -39.12 84.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 O-C-N 123.181 0.3 . . . . 0.0 110.508 -178.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -67.12 -40.38 86.8 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 109.762 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -64.09 -46.53 90.96 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.532 ' O ' HG13 ' A' ' 541' ' ' ILE . 43.7 mm -64.01 -37.38 79.65 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 C-N-CA 122.247 0.219 . . . . 0.0 110.799 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -57.87 -39.67 78.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 110.119 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' GLN . . . . . 0.528 ' HA ' HG22 ' A' ' 542' ' ' THR . 49.0 mt-30 -67.66 -34.09 76.23 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 91.1 t -67.41 -48.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.748 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 537' ' ' ILE . 62.2 mt -60.97 -44.88 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 542' ' ' THR . . . . . 0.546 ' HA ' ' OE2' ' A' ' 545' ' ' GLU . 1.9 t -67.86 -33.55 74.97 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.822 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.25 -42.55 88.42 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.79 -32.93 69.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.577 0.751 . . . . 0.0 110.664 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' GLU . . . . . 0.546 ' OE2' ' HA ' ' A' ' 542' ' ' THR . 44.3 mt-10 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.865 0.364 . . . . 0.0 111.099 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 23.0 m80 -97.76 -16.07 20.03 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.362 0.601 . . . . 0.0 110.613 -177.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -72.67 135.05 45.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.033 -175.028 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -82.08 92.95 6.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-O 121.309 0.576 . . . . 0.0 109.491 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -83.48 174.02 10.97 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.335 177.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -69.29 96.9 0.89 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.524 0.678 . . . . 0.0 109.6 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.4 t60 . . . . . 0 C--N 1.287 -2.137 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 -178.891 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 68.2 mtm . . . . . 0 CA--C 1.503 -0.831 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 23.0 t -108.73 145.54 34.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 178.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 61.8 t -80.79 131.05 34.85 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 27.7 m -71.51 123.45 22.45 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -72.37 -26.16 61.79 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.82 144.02 18.81 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 114.215 -1.357 . . . . 0.0 107.759 175.473 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 399' ' ' LEU . . . . . 0.48 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.2 mp -108.68 136.29 48.51 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 64.1 tp -70.1 118.83 13.43 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.19 -51.24 2.86 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.499 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 78.4 t90 -155.19 149.21 25.72 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.459 -172.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 13.1 p -130.61 117.63 19.81 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 176.695 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.499 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -159.54 -172.53 26.83 Favored Glycine 0 N--CA 1.433 -1.562 0 C-N-CA 119.795 -1.193 . . . . 0.0 112.589 -175.794 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -112.03 136.69 47.43 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-O 121.099 0.476 . . . . 0.0 109.876 -176.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.526 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.4 mp -113.19 139.08 49.07 Favored 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.491 ' HG3' ' HB3' ' A' ' 426' ' ' SER . 30.2 tt0 -116.22 126.83 54.16 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -178.411 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 408' ' ' TRP . . . . . 0.456 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 19.3 p-90 -107.15 131.86 53.66 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.46 0.647 . . . . 0.0 112.584 -175.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -106.67 138.82 42.13 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.227 -177.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -44.34 -60.52 1.89 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.934 1.294 . . . . 0.0 111.425 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -156.72 147.28 16.12 Favored Pre-proline 0 N--CA 1.426 -1.668 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 -178.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -50.43 113.91 1.23 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.726 2.284 . . . . 0.0 111.753 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 64.6 mttp 71.09 80.27 0.19 Allowed Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 124.633 1.173 . . . . 0.0 112.993 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -105.4 39.07 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.737 2.958 . . . . 0.0 109.706 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -82.6 -34.12 27.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.17 -174.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 5.6 p -94.6 -53.09 4.02 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.823 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.29 120.54 63.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 418' ' ' ASP . . . . . 0.406 ' HB2' HG23 ' A' ' 421' ' ' THR . 7.2 p-10 -115.36 148.18 39.61 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -86.61 -39.89 15.69 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -160.99 88.43 0.76 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.388 1.075 . . . . 0.0 110.591 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 421' ' ' THR . . . . . 0.406 HG23 ' HB2' ' A' ' 418' ' ' ASP . 2.9 p -79.16 -96.05 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.033 173.243 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt 62.67 -68.0 0.08 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.679 1.592 . . . . 0.0 111.185 -178.4 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 52.7 tp -146.44 132.17 18.95 Favored 'General case' 0 C--N 1.277 -2.565 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 -178.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 1.5 m -76.35 146.83 38.53 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.23 144.29 33.13 Favored 'General case' 0 N--CA 1.416 -2.164 0 C-N-CA 117.159 -1.816 . . . . 0.0 111.321 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 407' ' ' GLU . 51.4 p -142.2 138.55 31.57 Favored 'General case' 0 N--CA 1.409 -2.506 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 81.1 mt -135.41 135.77 23.0 Favored Pre-proline 0 C--N 1.307 -1.242 0 O-C-N 122.852 0.095 . . . . 0.0 110.861 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.45 135.93 20.9 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.573 2.182 . . . . 0.0 112.043 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 429' ' ' CYS . . . . . 0.526 ' SG ' HD13 ' A' ' 406' ' ' LEU . 20.3 p -142.29 167.13 22.84 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.493 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -115.79 129.88 56.62 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 45.3 t -114.05 123.98 70.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.719 0 CA-C-O 122.143 0.973 . . . . 0.0 110.792 -175.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -113.47 160.42 18.48 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 114.035 -1.439 . . . . 0.0 107.39 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 471' ' ' VAL . 15.4 m -122.75 141.77 41.87 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 CA-C-O 120.694 0.283 . . . . 0.0 111.6 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 470' ' ' MET . 3.0 m120 -94.59 132.16 39.59 Favored 'General case' 1 C--O 1.314 4.448 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 168.529 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.48 ' CD2' HD11 ' A' ' 399' ' ' LEU . 73.4 m-70 -39.26 165.72 0.0 OUTLIER 'General case' 0 C--N 1.37 1.463 0 O-C-N 127.387 2.929 . . . . 0.0 116.197 -168.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.33 -2.39 31.1 Favored Glycine 0 CA--C 1.502 -0.766 0 N-CA-C 109.096 -1.601 . . . . 0.0 109.096 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.409 ' CB ' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -106.63 161.91 14.22 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.05 -1.075 . . . . 0.0 113.118 -174.439 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -160.88 94.49 1.03 Allowed 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 439' ' ' LEU . . . . . 0.512 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 2.3 pt? -141.92 151.22 42.41 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.252 178.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -102.47 135.49 44.0 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.432 HG21 ' HB2' ' A' ' 402' ' ' TRP . 14.0 p -94.6 23.15 5.54 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -171.785 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -75.55 -28.33 58.97 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.255 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -72.07 -15.52 62.01 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.208 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -88.24 126.84 59.32 Favored Pre-proline 0 C--N 1.311 -1.07 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.455 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 445' ' ' PRO . . . . . 0.435 ' HG2' ' HD2' ' A' ' 501' ' ' PRO . 23.5 Cg_exo -69.84 157.88 58.73 Favored 'Trans proline' 0 C--O 1.224 -0.223 0 C-N-CA 122.186 1.924 . . . . 0.0 110.05 173.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -77.35 -5.98 51.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.128 0.489 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -119.9 124.94 47.27 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' LEU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 406' ' ' LEU . 53.2 mt -118.17 146.69 44.01 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 71.8 mt -101.93 117.79 47.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.887 -176.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.456 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 23.3 ptm -112.82 128.96 56.58 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 121.586 0.708 . . . . 0.0 110.067 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -114.76 130.75 56.89 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.99 124.63 29.31 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.498 0.666 . . . . 0.0 111.503 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.6 pt -133.82 161.42 63.84 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.395 1.078 . . . . 0.0 108.814 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -65.64 128.98 21.18 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 121.385 1.39 . . . . 0.0 111.406 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -63.86 -26.61 68.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.586 0.754 . . . . 0.0 110.388 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.27 -33.02 67.19 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.335 1.054 . . . . 0.0 112.7 -174.067 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 540' ' ' VAL . 90.8 mt -87.06 8.79 22.03 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 39.0 tp -69.73 -22.68 63.36 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.303 0.573 . . . . 0.0 110.483 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 5.1 m -65.62 -29.52 70.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.671 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 9.9 m -72.04 -20.39 61.69 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.757 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 83.1 mt -96.03 10.33 37.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.599 -175.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.22 -51.5 8.99 Favored Glycine 0 CA--C 1.553 2.462 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.1 -19.5 66.6 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.893 2.395 . . . . 0.0 113.94 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -80.16 -42.36 23.57 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -71.68 -13.66 61.8 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.583 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -53.86 -31.79 50.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.14 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -138.13 97.84 3.49 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.9 m -150.4 170.21 19.59 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.292 0.568 . . . . 0.0 111.553 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.512 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 97.3 mtt180 -112.52 142.51 45.0 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.669 ' HB2' ' HB2' ' A' ' 434' ' ' ASN . 61.5 mtp -98.78 151.96 20.22 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 116.944 -1.903 . . . . 0.0 111.242 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 433' ' ' VAL . 26.4 m -135.09 155.39 37.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.891 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -127.76 129.76 47.59 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 25.0 m-85 -112.88 117.98 33.63 Favored 'General case' 0 C--N 1.282 -2.326 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.847 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -121.31 123.73 42.88 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 57.8 m-85 -81.02 153.14 27.58 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.624 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' THR . . . . . 0.4 ' OG1' ' HG2' ' A' ' 478' ' ' LYS . 18.8 p -71.58 -9.96 59.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -173.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 63.17 28.02 15.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.481 0.713 . . . . 0.0 111.231 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' A' ' 478' ' ' LYS . 10.7 mmpt? -64.82 -46.08 83.47 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.272 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -130.47 102.38 6.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 80.7 mt -66.19 -33.74 76.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.261 -174.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -70.5 -36.55 73.86 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.944 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 38.7 m -65.09 -38.0 89.34 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.13 -41.86 89.91 Favored 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.007 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -54.41 -41.26 69.11 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.037 0.535 . . . . 0.0 111.6 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.488 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -63.15 -46.51 93.05 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.708 178.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.0 tp -66.7 -41.59 87.77 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.73 0.412 . . . . 0.0 110.737 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -61.16 -38.89 88.09 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.237 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -66.39 -46.0 78.13 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 485' ' ' GLY . 67.6 mt -62.55 -51.15 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 490' ' ' MET . . . . . 0.487 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 85.3 mtp -73.46 -36.19 65.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.117 0.484 . . . . 0.0 111.558 -176.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.34 71.03 Favored Glycine 0 C--O 1.219 -0.804 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.602 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.5 4.97 25.62 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.036 0.934 . . . . 0.0 110.611 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.57 29.52 6.96 Favored Glycine 0 C--N 1.316 -0.581 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.042 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -112.61 147.38 36.82 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 174.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -118.61 159.98 22.62 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.05 115.87 3.19 Favored Glycine 0 N--CA 1.421 -2.327 0 C-N-CA 120.189 -1.005 . . . . 0.0 110.721 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' CYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.1 t -88.32 128.3 35.49 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 75.6 t -100.99 120.57 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-O 121.664 0.745 . . . . 0.0 109.3 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.0 m-70 -113.42 134.66 54.53 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -84.12 132.24 48.58 Favored Pre-proline 0 C--N 1.289 -2.061 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.035 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' A' ' 445' ' ' PRO . 31.4 Cg_exo -62.71 3.4 0.51 Allowed 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.595 2.863 . . . . 0.0 114.72 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 49.1 m170 -103.2 115.76 31.19 Favored 'General case' 0 C--N 1.271 -2.835 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 172.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 15.6 p -110.41 35.21 3.53 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.571 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -71.54 126.5 91.65 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.264 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.02 -6.51 13.03 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.301 2.667 . . . . 0.0 112.042 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 56.1 m -74.53 0.08 15.96 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.439 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 80.73 93.93 0.05 OUTLIER 'General case' 0 C--O 1.244 0.785 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 170.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.03 -16.14 8.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 172.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 75.14 -178.67 0.16 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.395 1.478 . . . . 0.0 109.754 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.7 m -138.14 162.83 30.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.854 -0.739 . . . . 0.0 109.855 176.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.57 HD13 ' HB ' ' A' ' 526' ' ' ILE . 17.7 tp -135.01 150.04 50.26 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -170.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 40.2 tpp -108.93 140.78 41.95 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.529 HD11 ' HB3' ' A' ' 522' ' ' PHE . 52.7 tp -125.57 122.89 37.81 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.244 0.545 . . . . 0.0 109.952 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 73.3 mt -126.98 139.31 53.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.114 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -93.83 124.55 37.9 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.559 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 16.9 m -106.7 110.58 22.8 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 176.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 18.5 m -68.57 -35.68 77.71 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.834 -1.075 . . . . 0.0 113.218 -174.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -77.3 -29.41 53.69 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 121.449 0.643 . . . . 0.0 110.113 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -87.32 -10.62 51.78 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.89 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 58.24 27.41 15.13 Favored 'General case' 0 C--N 1.345 0.371 0 C-N-CA 124.876 1.27 . . . . 0.0 111.709 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.33 166.58 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.568 0 CA-C-O 121.232 0.539 . . . . 0.0 111.688 -176.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 42.5 m-85 -98.49 138.57 35.52 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.005 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 58.3 ttp -133.35 143.08 48.74 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' GLY . . . . . 0.429 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -151.89 158.94 28.05 Favored Glycine 0 N--CA 1.414 -2.77 0 C-N-CA 119.253 -1.451 . . . . 0.0 112.475 -178.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.479 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 10.3 mp -115.3 139.45 49.96 Favored 'General case' 0 C--N 1.291 -1.94 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.638 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.57 ' HB ' HD13 ' A' ' 511' ' ' LEU . 4.9 tt -107.05 108.32 61.81 Favored Pre-proline 0 C--O 1.254 1.324 0 CA-C-O 120.941 0.4 . . . . 0.0 111.65 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.516 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.2 Cg_exo -72.12 138.66 31.17 Favored 'Trans proline' 0 C--O 1.294 3.294 0 C-N-CA 123.433 2.755 . . . . 0.0 113.066 172.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -71.3 -45.32 63.34 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 113.114 -1.857 . . . . 0.0 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.02 104.69 13.41 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.364 0.602 . . . . 0.0 111.166 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -67.12 -36.07 81.12 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.626 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 80.3 p -63.71 -47.66 80.22 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -72.1 -38.74 59.32 Favored Glycine 0 N--CA 1.434 -1.477 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.432 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.497 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 44.9 t80 -71.05 -47.36 58.94 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.245 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.55 -38.53 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.318 0.58 . . . . 0.0 109.61 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -59.59 -41.47 90.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.809 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -67.85 -41.81 87.58 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.176 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.497 ' O ' HG13 ' A' ' 541' ' ' ILE . 47.6 mm -61.55 -36.7 74.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 122.492 0.317 . . . . 0.0 110.433 177.534 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -56.39 -38.69 71.82 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.863 0.363 . . . . 0.0 110.525 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -67.3 -41.8 84.79 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 457' ' ' LEU . 54.4 t -63.28 -43.87 98.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.118 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 537' ' ' ILE . 71.9 mt -59.98 -44.58 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.464 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 83.4 m -62.84 -38.94 92.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.741 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -67.55 -38.21 83.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.087 0.47 . . . . 0.0 110.026 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.57 -27.53 68.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.988 178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.94 -27.96 63.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.068 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.39 -43.25 27.99 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 175.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 54.7 84.07 0.07 Allowed 'General case' 0 C--O 1.242 0.689 0 C-N-CA 125.284 1.433 . . . . 0.0 112.473 174.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -90.63 88.48 7.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -83.13 146.0 28.9 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 176.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -59.14 -52.95 63.49 Favored 'General case' 0 C--N 1.317 -0.839 0 O-C-N 123.628 0.58 . . . . 0.0 110.367 178.138 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 . . . . . 0 C--O 1.247 0.935 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 177.103 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 15.7 m 74.32 -62.69 0.45 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.805 1.242 . . . . 0.0 112.342 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 47.7 t 64.02 95.55 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.725 1.21 . . . . 0.0 110.768 -177.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 396' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 398' ' ' LYS . 31.7 m -95.91 177.92 5.6 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -70.16 -42.72 72.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.433 0.635 . . . . 0.0 109.47 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 398' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 396' ' ' SER . 63.6 mttp -111.42 160.94 16.63 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 171.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -90.33 122.49 33.27 Favored 'General case' 0 C--N 1.284 -2.256 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.096 -175.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 60.0 tp -62.36 116.35 4.98 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 175.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.29 -52.92 2.26 Favored 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.54 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 51.4 t90 -146.34 133.66 20.65 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 118.85 -1.14 . . . . 0.0 112.71 -170.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 38.5 t -111.2 119.94 40.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.54 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.08 -173.46 26.53 Favored Glycine 0 N--CA 1.426 -1.974 0 C-N-CA 119.411 -1.376 . . . . 0.0 112.43 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.2 142.44 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.048 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 406' ' ' LEU . . . . . 0.427 HD11 ' CE1' ' A' ' 473' ' ' PHE . 88.9 mt -112.67 138.49 49.39 Favored 'General case' 0 C--N 1.293 -1.868 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.561 ' HB3' HG22 ' A' ' 424' ' ' THR . 26.3 mt-10 -115.67 125.73 53.23 Favored 'General case' 0 N--CA 1.402 -2.858 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.979 175.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -123.7 148.8 46.22 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.374 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -140.36 143.64 35.84 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.07 172.87 7.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.02 0.438 . . . . 0.0 111.396 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -120.59 110.79 35.18 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.74 -56.53 0.39 Allowed 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 121.872 1.715 . . . . 0.0 108.907 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 164.5 140.72 0.03 OUTLIER Pre-proline 0 CA--C 1.508 -0.638 0 C-N-CA 127.68 2.392 . . . . 0.0 104.731 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -61.98 107.55 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 121.353 1.369 . . . . 0.0 110.315 173.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -92.43 -8.78 43.78 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.065 0.936 . . . . 0.0 108.652 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.3 t -140.38 -165.78 1.99 Allowed 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 7.5 p -73.62 -36.39 47.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.089 0.471 . . . . 0.0 110.467 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -95.37 118.65 32.5 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.43 -3.72 58.77 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -84.9 78.42 9.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.168 0.985 . . . . 0.0 111.469 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 5.9 t -131.85 72.9 1.51 Allowed 'General case' 0 N--CA 1.418 -2.034 0 CA-C-O 122.975 1.369 . . . . 0.0 109.268 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -167.54 165.22 14.72 Favored 'General case' 0 N--CA 1.426 -1.674 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 93.4 mt -115.44 152.4 32.97 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 424' ' ' THR . . . . . 0.561 HG22 ' HB3' ' A' ' 407' ' ' GLU . 5.7 m -78.85 130.27 35.49 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 425' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 31.0 mmt180 -119.46 146.68 45.2 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.155 -177.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 2.9 p -110.84 139.94 45.72 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -173.139 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 427' ' ' LEU . . . . . 0.526 HD13 HD23 ' A' ' 483' ' ' LEU . 77.2 mt -137.12 125.09 14.5 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.985 175.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.23 146.62 32.07 Favored 'Trans proline' 0 C--O 1.248 0.979 0 C-N-CA 122.707 2.271 . . . . 0.0 111.605 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 21.7 p -147.49 167.46 24.4 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.817 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -116.48 129.89 56.46 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 41.4 t -124.87 123.85 66.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.923 0 CA-C-O 121.988 0.899 . . . . 0.0 112.18 -175.762 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -109.13 158.6 17.63 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 27.8 m -121.77 139.82 47.66 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.994 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.795 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 48.6 t30 -95.72 131.83 41.57 Favored 'General case' 1 C--O 1.308 4.158 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 174.202 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.523 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 51.8 m80 -37.41 153.19 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 O-C-N 127.773 3.171 . . . . 0.0 116.448 -167.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.54 -2.42 30.77 Favored Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.929 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 437' ' ' GLU . . . . . 0.523 ' OE1' ' HA ' ' A' ' 435' ' ' HIS . 1.0 OUTLIER -82.36 161.08 22.66 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 124.281 1.032 . . . . 0.0 112.638 -173.712 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 66.6 m-20 -146.02 96.05 2.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.618 167.031 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 439' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 441' ' ' THR . 0.0 OUTLIER -140.34 141.37 35.67 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.088 175.175 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -104.06 106.85 17.5 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 105.107 -2.183 . . . . 0.0 105.107 166.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.565 HG23 HD23 ' A' ' 439' ' ' LEU . 8.1 p -70.13 -12.68 61.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.021 0.915 . . . . 0.0 112.588 -175.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -68.49 -22.75 64.53 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.63 174.128 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -103.58 12.52 34.88 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 122.305 1.05 . . . . 0.0 108.982 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' TRP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 445' ' ' PRO . 9.9 m0 -93.57 140.55 23.16 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 445' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 444' ' ' TRP . 16.9 Cg_exo -70.89 144.83 49.05 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 122.042 1.828 . . . . 0.0 109.045 171.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -81.35 -5.25 57.65 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.918 0.39 . . . . 0.0 111.183 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -128.25 120.19 26.66 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.994 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.33 147.18 41.82 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.9 mm -99.23 123.2 51.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.815 0.34 . . . . 0.0 110.207 -175.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.26 135.41 53.87 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.109 0.48 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' GLN . . . . . 0.581 ' HB3' ' SG ' ' A' ' 497' ' ' CYS . 8.1 tp-100 -117.83 131.13 56.6 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.546 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.94 125.07 33.8 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.9 pt -134.2 159.86 70.73 Favored Pre-proline 0 C--N 1.317 -0.839 0 C-N-CA 123.218 0.607 . . . . 0.0 110.16 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -64.11 129.31 23.98 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 121.861 1.707 . . . . 0.0 112.1 176.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 58.7 tt0 -63.55 -29.52 70.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.676 0.79 . . . . 0.0 111.386 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -57.75 -41.2 81.41 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.132 0.491 . . . . 0.0 111.93 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.403 HD12 HG13 ' A' ' 540' ' ' VAL . 73.8 mt -76.16 -8.73 57.69 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.568 -173.781 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 51.1 tp -70.15 -16.79 63.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.582 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.5 t -60.5 -25.18 65.89 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-O 121.026 0.441 . . . . 0.0 111.316 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 5.3 m -71.31 -19.33 62.33 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.438 0.695 . . . . 0.0 110.652 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.0 4.27 52.78 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.999 0.428 . . . . 0.0 111.443 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.32 -54.23 3.28 Favored Glycine 0 CA--C 1.548 2.129 0 CA-C-N 114.319 -1.31 . . . . 0.0 115.583 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.5 -20.84 51.26 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 122.914 2.409 . . . . 0.0 114.723 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.72 -36.96 59.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.835 -0.54 . . . . 0.0 110.884 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -68.97 -13.21 62.31 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.865 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.61 -36.13 79.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.85 89.02 3.03 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 109.592 175.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 525' ' ' LEU . 49.3 m -144.14 160.17 41.38 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.342 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -111.23 141.93 44.1 Favored 'General case' 0 C--N 1.284 -2.269 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.795 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 72.4 mtp -98.39 153.01 18.88 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 118.036 -1.466 . . . . 0.0 112.159 -170.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 22.1 m -134.18 162.15 39.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.596 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -133.29 123.08 24.84 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 173.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 17.2 m-85 -107.72 134.39 50.76 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.898 0.749 . . . . 0.0 110.068 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -133.93 123.51 24.81 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 172.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -87.34 152.84 21.93 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 121.204 -0.198 . . . . 0.0 110.761 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 10.9 t -76.96 119.03 20.13 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.843 0.83 . . . . 0.0 109.211 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -80.26 38.18 0.41 Allowed 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.125 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -84.48 -36.67 22.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.24 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -115.11 87.57 2.68 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.79 -28.94 68.79 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.676 -177.357 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -70.64 -41.7 71.82 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 9.3 t -67.75 -43.07 80.74 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.526 HD23 HD13 ' A' ' 427' ' ' LEU . 83.8 mt -64.69 -30.16 71.17 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.84 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 88.0 tttt -54.99 -47.27 74.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.115 0.566 . . . . 0.0 110.817 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -64.38 -42.04 97.85 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.957 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.8 tt -65.03 -45.05 87.06 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -60.31 -40.3 90.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.285 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 488' ' ' ARG . . . . . 0.562 ' HA ' ' CZ ' ' A' ' 488' ' ' ARG . 2.6 mmp_? -62.92 -50.28 71.46 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.714 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 76.3 mt -57.71 -45.47 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 122.703 0.401 . . . . 0.0 110.649 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 19.0 mmt -63.92 -43.87 94.59 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.312 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.93 -22.59 74.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.337 -0.392 . . . . 0.0 112.335 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -76.76 -7.02 54.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.822 0.449 . . . . 0.0 111.641 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.4 30.4 6.96 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 119.373 -1.394 . . . . 0.0 112.482 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.73 162.24 13.7 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -125.18 158.35 34.19 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -117.41 108.24 1.67 Allowed Glycine 0 N--CA 1.426 -1.988 0 C-N-CA 120.3 -0.952 . . . . 0.0 111.601 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 451' ' ' GLN . 10.6 p -83.87 118.55 24.04 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.4 121.28 55.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.17 136.09 50.74 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.219 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -97.64 133.46 23.54 Favored Pre-proline 0 C--N 1.291 -1.959 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.73 92.3 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.838 0 N-CA-C 107.909 -1.612 . . . . 0.0 107.909 169.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -77.47 130.48 37.06 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -170.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 4.2 m -84.12 -49.77 8.56 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.614 177.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.44 147.79 50.69 Favored Pre-proline 0 N--CA 1.439 -1.014 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.372 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -90.27 -22.17 0.8 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 122.172 1.914 . . . . 0.0 113.547 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 14.4 t -117.07 19.31 14.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.836 0.827 . . . . 0.0 108.975 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -160.19 164.38 32.88 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 48.0 t 75.55 97.54 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 107.416 -1.328 . . . . 0.0 107.416 -172.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 527' ' ' PRO . 11.1 mmt180 -98.06 -166.76 1.42 Allowed 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.091 -168.097 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 22.6 m -121.53 163.07 19.93 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.151 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.944 -177.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.559 ' HB2' HG12 ' A' ' 526' ' ' ILE . 14.4 tp -130.91 145.81 52.13 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -170.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 32.4 tpp -113.42 120.71 41.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.308 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.439 HD11 ' HB3' ' A' ' 522' ' ' PHE . 45.9 tp -105.87 126.8 52.61 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.226 0.536 . . . . 0.0 110.076 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 80.7 mt -132.36 148.75 52.43 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.435 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.25 128.65 52.02 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-O 120.702 0.286 . . . . 0.0 110.773 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 18.8 m -107.86 110.66 22.49 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.5 p -68.18 -35.87 78.71 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 124.43 1.092 . . . . 0.0 113.218 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.86 -33.38 66.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -97.39 -3.65 39.86 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.42 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 520' ' ' LYS . 24.9 tptp 59.67 36.62 22.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.795 1.238 . . . . 0.0 111.298 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -140.66 165.59 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.981 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.044 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 39.7 m-85 -103.39 132.52 49.58 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.0 ptm -110.8 157.6 19.61 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' GLY . . . . . 0.406 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -164.23 143.59 8.69 Favored Glycine 0 N--CA 1.405 -3.418 0 C-N-CA 119.094 -1.527 . . . . 0.0 112.021 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 525' ' ' LEU . . . . . 0.492 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 11.0 mp -114.92 137.74 51.63 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 172.626 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.8 mt -107.11 106.97 59.75 Favored Pre-proline 0 N--CA 1.428 -1.551 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.559 ' O ' ' HB3' ' A' ' 509' ' ' ARG . 29.4 Cg_exo -70.32 134.01 25.82 Favored 'Trans proline' 0 C--O 1.292 3.212 0 C-N-CA 123.186 2.591 . . . . 0.0 112.189 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -76.78 -27.43 55.28 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 113.37 -1.741 . . . . 0.0 112.058 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.04 90.11 7.99 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -66.82 -33.69 76.17 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.926 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.4 p -58.27 -48.32 80.81 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -174.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.76 -34.36 43.69 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.801 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' PHE . . . . . 0.407 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 51.6 t80 -68.52 -47.7 66.27 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 534' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 538' ' ' ARG . 89.6 t -62.65 -40.69 89.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 O-C-N 123.352 0.407 . . . . 0.0 110.22 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -57.64 -45.93 84.82 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' GLY . . . . . 0.447 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -69.18 -44.95 63.7 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.73 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 41.8 mm -63.32 -34.07 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 122.558 0.343 . . . . 0.0 111.754 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 534' ' ' VAL . 56.9 mtp180 -56.17 -46.77 79.22 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -63.94 -39.94 95.31 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.742 0.651 . . . . 0.0 109.57 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 536' ' ' GLY . 97.7 t -60.86 -48.09 90.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.553 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 79.5 mt -61.81 -45.47 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.07 0.462 . . . . 0.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 54.3 m -62.06 -40.37 95.55 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.647 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -67.69 -36.77 81.29 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -62.66 -36.08 81.7 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.27 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.63 -49.29 22.08 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -73.81 -49.01 27.27 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 68.37 -72.8 0.09 Allowed 'General case' 0 C--O 1.239 0.539 0 C-N-CA 125.117 1.367 . . . . 0.0 111.86 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 64.72 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 124.742 1.217 . . . . 0.0 109.897 -172.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -157.75 127.98 6.24 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -86.41 81.53 8.29 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 122.155 0.978 . . . . 0.0 111.499 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 . . . . . 0 C--N 1.299 -1.6 0 CA-C-N 115.033 -0.985 . . . . 0.0 108.603 -179.806 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 20.3 ptp . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 121.276 0.56 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 394' ' ' SER . . . . . 0.442 ' O ' ' HG ' ' A' ' 399' ' ' LEU . 50.6 m -115.31 2.7 14.06 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 121.365 0.603 . . . . 0.0 110.306 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 28.3 t -94.93 9.18 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-O 122.215 1.007 . . . . 0.0 108.708 -176.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 12.1 m -63.52 -29.58 70.82 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.809 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -171.29 -70.38 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.76 142.05 47.03 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.578 178.234 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 399' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 394' ' ' SER . 2.4 mp -108.84 119.34 39.25 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 67.1 tp -69.02 121.46 16.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -120.67 -46.02 2.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -176.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 402' ' ' TRP . . . . . 0.506 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 41.7 t90 -150.05 149.23 30.03 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.385 -174.182 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 10.3 p -133.66 117.71 17.32 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 173.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 404' ' ' GLY . . . . . 0.506 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.75 -172.29 25.67 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.306 -173.218 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 405' ' ' VAL . . . . . 0.536 HG12 ' HB2' ' A' ' 426' ' ' SER . 58.2 t -114.98 142.65 27.02 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 CA-C-O 121.023 0.44 . . . . 0.0 109.924 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 89.1 mt -113.05 133.36 55.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 407' ' ' GLU . . . . . 0.656 ' HG2' HG22 ' A' ' 424' ' ' THR . 38.3 tt0 -116.29 134.41 54.93 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 408' ' ' TRP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 450' ' ' MET . 14.4 p-90 -143.22 155.58 44.55 Favored 'General case' 0 C--O 1.252 1.214 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -173.282 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -109.53 157.57 18.87 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.696 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 410' ' ' GLU . . . . . 0.581 ' HB2' HH21 ' A' ' 425' ' ' ARG . 33.4 tt0 -121.89 -89.88 0.59 Allowed 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -92.69 161.94 30.62 Favored Pre-proline 0 C--O 1.22 -0.492 0 O-C-N 122.122 -0.361 . . . . 0.0 110.05 -175.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 121.524 1.482 . . . . 0.0 110.502 173.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 413' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 419' ' ' ALA . 97.5 mttt -114.91 122.45 33.59 Favored Pre-proline 0 N--CA 1.446 -0.653 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -77.81 -56.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.321 2.014 . . . . 0.0 112.279 -175.6 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -93.32 1.55 56.92 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.175 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.8 m 71.08 -46.64 0.64 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.212 1.405 . . . . 0.0 111.547 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 35.2 m -75.15 -16.64 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.639 0.733 . . . . 0.0 109.07 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -99.67 137.27 38.38 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 419' ' ' ALA . . . . . 0.41 ' HA ' ' HG2' ' A' ' 413' ' ' LYS . . . -88.11 -26.15 22.64 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -170.713 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -128.88 117.42 20.99 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -171.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 24.3 m -78.42 85.61 4.51 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.454 0.645 . . . . 0.0 109.96 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.61 6.08 44.05 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.331 0.586 . . . . 0.0 110.315 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -81.38 105.49 12.61 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 424' ' ' THR . . . . . 0.656 HG22 ' HG2' ' A' ' 407' ' ' GLU . 2.4 m -107.48 116.82 32.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 425' ' ' ARG . . . . . 0.581 HH21 ' HB2' ' A' ' 410' ' ' GLU . 0.0 OUTLIER -110.41 157.03 19.99 Favored 'General case' 0 C--N 1.278 -2.501 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.116 -176.97 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 426' ' ' SER . . . . . 0.536 ' HB2' HG12 ' A' ' 405' ' ' VAL . 60.4 p -131.65 159.27 38.81 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -170.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 427' ' ' LEU . . . . . 0.446 HD13 HD11 ' A' ' 483' ' ' LEU . 50.8 mt -127.09 135.32 27.22 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.651 0.78 . . . . 0.0 110.021 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -82.47 132.6 6.92 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.821 2.347 . . . . 0.0 112.208 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 23.7 p -143.71 163.85 32.12 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.377 0.608 . . . . 0.0 112.212 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -116.77 130.06 56.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 43.0 t -117.64 123.78 72.19 Favored 'Isoleucine or valine' 0 C--O 1.268 2.059 0 CA-C-O 122.071 0.938 . . . . 0.0 110.768 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -109.88 158.24 18.39 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.436 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 471' ' ' VAL . 33.4 m -121.67 141.52 41.77 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.37 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 434' ' ' ASN . . . . . 0.521 ' HB2' ' CB ' ' A' ' 470' ' ' MET . 92.2 m-20 -94.51 130.28 40.98 Favored 'General case' 1 C--O 1.308 4.147 0 N-CA-C 103.3 -2.852 . . . . 0.0 103.3 163.927 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 435' ' ' HIS . . . . . 0.438 ' HB3' ' CD2' ' A' ' 399' ' ' LEU 0.309 31.6 p-80 -63.47 -175.91 0.14 Allowed 'General case' 0 N--CA 1.426 -1.641 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 -160.919 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.44 -11.25 33.28 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 105.337 -3.105 . . . . 0.0 105.337 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -128.91 149.02 50.96 Favored 'General case' 0 N--CA 1.383 -3.811 0 C-N-CA 127.306 2.242 . . . . 0.0 105.958 177.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -161.73 102.88 1.18 Allowed 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -137.82 151.9 48.57 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.647 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -94.6 123.09 37.83 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 170.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' THR . . . . . 0.496 HG21 ' HB2' ' A' ' 402' ' ' TRP . 11.7 p -83.45 38.12 0.6 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -170.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -75.64 -23.74 56.37 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.89 0.853 . . . . 0.0 109.079 175.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -88.48 -0.78 57.58 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.541 -177.166 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -99.71 131.5 24.58 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.826 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 445' ' ' PRO . . . . . 0.408 ' HG3' ' OG1' ' A' ' 503' ' ' THR . 18.8 Cg_exo -69.18 162.76 40.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.73 1.62 . . . . 0.0 108.965 172.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -80.45 -7.23 59.07 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.068 -0.395 . . . . 0.0 110.849 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 56.4 mtpt -126.97 126.95 44.06 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.996 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 64.2 mt -113.26 148.46 35.52 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.881 177.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.38 122.8 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 -173.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 408' ' ' TRP . 79.9 mtp -100.14 118.5 36.61 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.642 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -110.81 113.87 26.79 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.1 mt -76.49 127.25 32.47 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 31.3 pt -136.59 161.6 60.98 Favored Pre-proline 0 C--N 1.309 -1.177 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.42 128.85 15.02 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 CA-C-N 120.109 1.075 . . . . 0.0 111.569 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -62.97 -26.35 68.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.164 0.986 . . . . 0.0 110.698 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -57.48 -38.63 74.83 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.649 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 63.9 mt -87.06 -2.06 58.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.954 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.8 tt -72.78 -24.19 60.9 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.302 0.641 . . . . 0.0 111.284 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.5 m -57.03 -31.51 65.23 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.675 0.79 . . . . 0.0 112.045 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.8 m -71.86 -18.04 62.09 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 121.3 0.571 . . . . 0.0 111.951 -177.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.18 0.85 52.68 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.851 -0.531 . . . . 0.0 111.539 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' GLY . . . . . 0.413 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -39.7 -52.32 3.12 Favored Glycine 0 CA--C 1.551 2.288 0 CA-C-N 114.4 -1.273 . . . . 0.0 115.355 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 463' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 6.8 Cg_endo -50.25 -33.17 35.45 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.534 2.823 . . . . 0.0 114.021 178.222 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.64 -38.42 65.02 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 110.18 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -69.04 -13.62 62.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.537 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.23 -11.61 59.61 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.568 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.17 92.05 2.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.277 1.037 . . . . 0.0 108.995 171.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 61.7 m -148.14 169.86 19.08 Favored 'General case' 0 N--CA 1.422 -1.868 0 CA-C-O 121.987 0.898 . . . . 0.0 111.922 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' ARG . . . . . 0.422 ' HG3' ' HB ' ' A' ' 526' ' ' ILE . 10.7 ptm180 -111.29 142.16 43.88 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 126.739 2.016 . . . . 0.0 107.384 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' MET . . . . . 0.521 ' CB ' ' HB2' ' A' ' 434' ' ' ASN . 2.7 mmm -97.62 148.84 22.89 Favored 'General case' 0 CA--C 1.483 -1.628 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.673 -173.464 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 433' ' ' VAL . 21.4 m -138.32 151.6 24.91 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -127.01 128.89 47.06 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' PHE . . . . . 0.436 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 22.1 m-85 -107.77 116.54 32.14 Favored 'General case' 0 C--O 1.271 2.226 0 CA-C-O 121.867 0.841 . . . . 0.0 110.419 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -123.57 122.57 38.52 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 105.898 -1.889 . . . . 0.0 105.898 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -89.89 157.94 17.66 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 19.1 p -71.99 -74.71 0.15 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -91.51 144.17 25.83 Favored 'General case' 0 CA--C 1.444 -3.114 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 483' ' ' LEU . 1.4 mppt? -74.76 -2.16 25.25 Favored 'General case' 0 C--N 1.264 -3.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 108.666 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 8.5 t70 42.71 68.14 0.53 Allowed 'General case' 0 CA--C 1.46 -2.513 0 C-N-CA 126.875 2.07 . . . . 0.0 107.166 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.434 ' HG ' ' H ' ' A' ' 480' ' ' LEU . 27.4 mt -47.2 -34.03 5.95 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 109.89 -3.323 . . . . 0.0 115.185 -166.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.22 -51.53 20.65 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 118.944 0.793 . . . . 0.0 110.929 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 17.9 m -71.27 -47.55 56.28 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -173.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 478' ' ' LYS . 8.0 mp -73.87 -19.27 60.77 Favored 'General case' 0 C--O 1.193 -1.878 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.389 -177.493 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -62.52 -34.43 76.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.621 0.724 . . . . 0.0 109.158 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -69.77 -47.13 50.04 Favored Glycine 0 N--CA 1.438 -1.205 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.872 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -39.21 90.71 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.942 0.897 . . . . 0.0 111.729 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' TYR . . . . . 0.467 ' CE1' ' HB3' ' A' ' 483' ' ' LEU . 6.0 m-30 -61.19 -40.36 93.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.631 0.373 . . . . 0.0 110.369 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -67.13 -38.23 85.2 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.088 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 485' ' ' GLY . 64.0 mt -64.19 -49.51 80.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.08 0.466 . . . . 0.0 110.149 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 15.4 mmt -63.85 -35.5 80.83 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.29 -14.38 81.97 Favored Glycine 0 CA--C 1.527 0.828 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.078 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -84.17 -0.91 53.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.585 0.707 . . . . 0.0 109.676 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.89 29.99 6.99 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.861 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -107.02 161.6 14.59 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 120.945 0.403 . . . . 0.0 111.139 176.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -136.28 160.11 39.71 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -120.49 106.04 1.13 Allowed Glycine 0 N--CA 1.423 -2.221 0 C-N-CA 119.712 -1.233 . . . . 0.0 111.33 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' CYS . . . . . 0.426 ' SG ' HG21 ' A' ' 537' ' ' ILE . 49.9 t -82.88 123.38 29.33 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.95 120.85 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.131 0 CA-C-O 121.477 0.656 . . . . 0.0 110.165 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -107.74 143.48 36.2 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.562 -1.199 . . . . 0.0 108.377 176.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -98.68 129.77 29.34 Favored Pre-proline 0 C--N 1.285 -2.211 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.634 -175.341 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -60.03 162.55 16.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 122.402 2.068 . . . . 0.0 110.845 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -77.44 120.79 22.92 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.168 0.509 . . . . 0.0 111.191 -173.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' THR . . . . . 0.408 ' OG1' ' HG3' ' A' ' 445' ' ' PRO . 49.6 m -152.41 -45.89 0.1 Allowed 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.231 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.02 154.75 75.99 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.196 173.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -55.17 -33.45 84.27 Favored 'Trans proline' 0 N--CA 1.488 1.176 0 C-N-CA 122.91 2.407 . . . . 0.0 113.715 -176.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 36.3 t -178.89 -48.33 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLU . . . . . 0.426 ' HG3' HE22 ' A' ' 530' ' ' GLN . 36.3 tt0 -81.1 104.05 11.32 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.233 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.6 p -111.63 -26.62 3.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.436 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 73.86 149.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.986 1.314 . . . . 0.0 109.222 -178.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.5 m -122.38 160.15 24.84 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.041 0 C-N-CA 117.326 -1.75 . . . . 0.0 111.883 -174.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.549 ' HB2' HG12 ' A' ' 526' ' ' ILE . 13.5 tp -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -170.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 43.0 tpp -109.56 114.4 28.0 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.531 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -101.35 123.98 46.3 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.264 0.554 . . . . 0.0 110.037 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 72.7 mt -126.35 148.87 49.5 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.311 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -97.96 130.48 44.81 Favored 'General case' 0 C--N 1.273 -2.72 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.301 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 46.1 t -102.5 109.97 21.77 Favored 'General case' 0 N--CA 1.411 -2.379 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 33.7 p -69.64 -19.81 63.61 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.531 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -65.52 -44.32 87.32 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.037 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' LYS . . . . . 0.413 ' HB2' HG13 ' A' ' 521' ' ' ILE . 67.4 mttm -105.85 -9.86 16.97 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.426 -177.109 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 69.14 28.72 4.9 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.084 0.954 . . . . 0.0 110.737 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 521' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 519' ' ' LYS . 2.5 pp -134.62 168.82 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.835 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.022 -175.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 522' ' ' PHE . . . . . 0.531 ' HB3' HD11 ' A' ' 513' ' ' LEU . 19.2 m-85 -104.67 139.61 39.26 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.203 -172.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 22.9 mmt -124.17 160.31 28.14 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.89 153.6 21.13 Favored Glycine 0 N--CA 1.416 -2.634 0 C-N-CA 118.805 -1.664 . . . . 0.0 112.823 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -114.69 140.02 49.19 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 172.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.0 mt -108.21 107.6 60.35 Favored Pre-proline 0 N--CA 1.427 -1.585 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 33.5 Cg_exo -68.09 133.86 30.05 Favored 'Trans proline' 0 C--O 1.296 3.388 0 C-N-CA 122.441 2.094 . . . . 0.0 112.846 171.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.2 -35.2 68.87 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 113.092 -1.867 . . . . 0.0 106.848 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.11 65.73 0.81 Allowed 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.291 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' GLN . . . . . 0.426 HE22 ' HG3' ' A' ' 507' ' ' GLU . 4.0 pt20 -66.78 -38.04 85.77 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.59 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 12.2 m -63.81 -41.6 97.85 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 -177.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.42 -42.9 21.48 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.0 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -64.33 -47.47 79.26 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.197 0.199 . . . . 0.0 111.337 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.97 -39.04 82.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.02 -37.64 87.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.368 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -72.41 -47.3 29.2 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.385 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' ILE . . . . . 0.426 HG21 ' SG ' ' A' ' 497' ' ' CYS . 38.9 mm -62.97 -33.92 63.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 122.963 0.505 . . . . 0.0 111.837 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -56.14 -42.08 76.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 122.922 0.489 . . . . 0.0 110.034 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.1 tt0 -66.2 -41.56 90.02 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.811 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 71.7 t -60.89 -44.87 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.043 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' ILE . . . . . 0.511 ' O ' ' HG3' ' A' ' 545' ' ' GLU . 90.3 mt -62.4 -45.72 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.84 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 19.0 m -67.48 -36.54 81.32 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.412 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -66.94 -37.03 83.56 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 177.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.56 -41.53 97.52 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.795 174.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' GLU . . . . . 0.511 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 47.2 mt-10 -62.55 -27.97 69.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.195 0.521 . . . . 0.0 111.268 178.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 67.0 m80 -83.4 -48.17 10.64 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.279 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -67.03 -44.45 80.19 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.448 -176.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -106.82 99.22 8.81 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.636 0.255 . . . . 0.0 110.336 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 45.2 p-80 -132.58 82.92 2.03 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 122.201 1.001 . . . . 0.0 110.032 174.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -92.61 -17.59 24.16 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.04 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 77.1 t60 . . . . . 0 N--CA 1.425 -1.723 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.846 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.311 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 399' ' ' LEU . 2.9 mp -102.03 134.52 45.12 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -174.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.77 124.72 27.76 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.03 -41.24 2.77 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.456 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 54.9 t90 -148.8 149.71 31.82 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -173.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.6 m -138.98 117.67 12.24 Favored 'General case' 0 C--N 1.275 -2.643 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.456 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -160.58 -172.46 27.87 Favored Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.8 t -108.98 142.11 22.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -175.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.444 ' HG ' ' SG ' ' A' ' 429' ' ' CYS . 86.0 mt -113.12 141.46 46.88 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.503 ' OE2' ' HG2' ' A' ' 447' ' ' LYS . 35.8 mt-10 -116.04 125.18 52.1 Favored 'General case' 0 N--CA 1.405 -2.688 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 174.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . 0.44 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 64.9 p-90 . . . . . 0 N--CA 1.425 -1.692 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.452 -173.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 38.1 mmt180 . . . . . 0 CA--C 1.499 -0.999 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 27.7 p -108.89 144.84 36.28 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 123.635 0.584 . . . . 0.0 110.987 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 20.9 tp -146.97 126.89 6.7 Favored Pre-proline 0 C--N 1.305 -1.363 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.97 142.05 24.59 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.396 2.064 . . . . 0.0 112.17 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . 0.444 ' SG ' ' HG ' ' A' ' 406' ' ' LEU . 26.0 p -144.29 163.49 33.56 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.376 0.608 . . . . 0.0 111.78 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -117.25 129.18 55.75 Favored 'General case' 0 N--CA 1.423 -1.792 0 N-CA-C 104.404 -2.443 . . . . 0.0 104.404 174.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 48.0 t -117.17 125.29 73.86 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.973 0 CA-C-O 121.794 0.807 . . . . 0.0 110.384 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -108.04 160.98 15.37 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 30.5 m -121.25 141.29 42.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.709 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 53.8 t30 -94.1 131.31 39.75 Favored 'General case' 1 C--O 1.359 6.855 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 173.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -38.43 148.1 0.05 OUTLIER 'General case' 0 C--N 1.363 1.161 3 O-C-N 130.865 5.103 . . . . 0.0 118.987 -161.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.51 -18.44 35.34 Favored Glycine 0 CA--C 1.494 -1.273 0 CA-C-N 112.528 -2.124 . . . . 0.0 110.858 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.606 ' OE2' ' HA ' ' A' ' 469' ' ' ARG . 5.6 mm-40 -98.07 118.0 33.69 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 114.329 -0.936 . . . . 0.0 110.806 -170.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -108.73 108.45 19.28 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -138.23 156.02 48.08 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -102.39 121.38 42.21 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-O 121.316 0.579 . . . . 0.0 111.034 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.402 HG21 ' HB2' ' A' ' 402' ' ' TRP . 4.3 p -88.71 -13.59 39.29 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -174.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.96 -19.01 65.72 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.567 0.699 . . . . 0.0 109.626 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -82.1 -10.87 59.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.448 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -84.0 141.76 40.99 Favored Pre-proline 0 C--O 1.245 0.864 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -67.31 163.18 35.48 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.567 2.178 . . . . 0.0 109.799 171.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -81.84 -9.93 59.47 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.503 ' HG2' ' OE2' ' A' ' 407' ' ' GLU . 1.8 mptm? -124.47 135.99 53.67 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.915 172.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . 0.43 HD22 ' CD1' ' A' ' 500' ' ' PHE . 56.3 mt -118.5 146.69 44.33 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 59.1 mt -98.82 116.93 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 22.5 ptm -122.87 134.32 54.39 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.429 0.633 . . . . 0.0 112.186 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -116.71 133.82 55.55 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.52 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -81.58 110.37 16.89 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.296 0.569 . . . . 0.0 110.013 177.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 2.4 pp -118.4 152.95 51.59 Favored Pre-proline 0 C--N 1.301 -1.519 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.713 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.96 128.69 20.24 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 121.032 1.155 . . . . 0.0 113.159 -177.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.27 -25.88 68.52 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.137 1.375 . . . . 0.0 110.595 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -57.28 -41.16 79.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.461 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 8.3 mp -85.88 -8.89 57.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.984 0.421 . . . . 0.0 111.219 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.49 -20.0 55.01 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.201 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 11.4 m -57.52 -28.72 63.74 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.015 0.926 . . . . 0.0 110.489 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.55 -22.42 65.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.094 -177.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.59 9.64 42.8 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.653 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -42.7 -55.89 4.49 Favored Glycine 0 CA--C 1.543 1.835 0 N-CA-C 116.31 1.284 . . . . 0.0 116.31 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.75 -19.79 59.22 Favored 'Trans proline' 0 C--N 1.362 1.289 0 CA-C-N 120.122 1.961 . . . . 0.0 113.17 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.22 -22.37 55.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.358 0.599 . . . . 0.0 109.997 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.0 -13.54 61.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.957 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -72.61 -9.87 59.12 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.53 81.29 1.88 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.155 0.978 . . . . 0.0 110.164 173.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . 0.425 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 51.8 m -155.35 169.42 24.26 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.239 -175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.606 ' HA ' ' OE2' ' A' ' 437' ' ' GLU . 0.1 OUTLIER -109.79 141.72 42.04 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -176.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.709 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 41.1 mtp -97.7 149.04 22.72 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 113.593 -3.243 . . . . 0.0 111.347 -172.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 11.6 m -135.17 160.58 40.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.371 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -139.77 133.62 30.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 65.2 m-85 -107.95 125.3 51.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-O 121.628 0.728 . . . . 0.0 110.748 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -121.32 123.2 41.59 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . 0.416 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 78.1 m-85 . . . . . 0 C--N 1.287 -2.139 0 C-N-CA 119.535 -0.866 . . . . 0.0 113.075 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 85.0 mt . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 112.077 0.399 . . . . 0.0 112.077 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -65.6 -40.64 92.9 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.622 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.8 m -66.54 -41.42 88.74 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.36 -48.18 80.92 Favored 'General case' 0 C--O 1.201 -1.495 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.777 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 37.5 ttpt -55.35 -47.03 76.34 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 123.517 0.727 . . . . 0.0 110.868 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -63.24 -43.23 98.84 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.473 HD21 ' SD ' ' A' ' 490' ' ' MET . 9.5 tt -66.28 -38.58 88.11 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 123.19 0.596 . . . . 0.0 110.91 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -56.55 -41.39 76.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.172 0.589 . . . . 0.0 110.714 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 484' ' ' LYS . 24.8 mmt180 -60.97 -47.26 87.28 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 75.9 mt -68.44 -52.8 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.981 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . 0.473 ' SD ' HD21 ' A' ' 486' ' ' LEU . 87.3 mtp -76.18 -23.1 54.7 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.046 -0.662 . . . . 0.0 112.184 -175.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -81.41 -12.1 82.41 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.085 -0.578 . . . . 0.0 111.737 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -92.75 3.8 54.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.67 0.748 . . . . 0.0 110.008 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.93 30.15 6.54 Favored Glycine 0 N--CA 1.435 -1.4 0 C-N-CA 119.63 -1.271 . . . . 0.0 113.159 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -104.71 141.0 37.24 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 170.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . 0.42 ' HB1' ' SD ' ' A' ' 512' ' ' MET . . . -118.54 147.91 43.19 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -178.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -104.12 104.88 2.51 Favored Glycine 0 N--CA 1.421 -2.352 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 537' ' ' ILE . 42.1 t -82.88 119.83 24.89 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 511' ' ' LEU . 61.5 t -101.25 121.17 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.645 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -109.01 137.94 46.13 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . 0.461 ' HD2' ' O ' ' A' ' 509' ' ' ARG . 95.5 m-85 -92.49 133.82 29.05 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo . . . . . 0 C--O 1.25 1.087 0 C-N-CA 122.156 1.904 . . . . 0.0 110.604 172.426 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.409 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 31.6 t . . . . . 0 CA--C 1.538 0.498 0 N-CA-C 110.377 -0.231 . . . . 0.0 110.377 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.461 ' O ' ' HD2' ' A' ' 500' ' ' PHE . 96.8 mtt180 -169.76 -176.95 2.52 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.193 -3.262 . . . . 0.0 102.193 -174.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.8 m -134.93 155.97 39.04 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.749 0 CA-C-N 120.832 1.651 . . . . 0.0 111.235 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.618 HD13 ' HB ' ' A' ' 526' ' ' ILE . 40.6 tp -125.52 148.84 48.74 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-O 120.899 0.38 . . . . 0.0 111.609 -172.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . 0.42 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 39.0 tpp -113.78 138.76 49.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 175.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' A' ' 522' ' ' PHE . 0.9 OUTLIER -117.5 124.84 49.73 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.072 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.41 139.81 50.59 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 123.605 0.762 . . . . 0.0 109.588 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -94.27 122.94 37.33 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.926 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.9 p -105.83 110.62 22.98 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 12.4 m -68.45 -32.11 71.89 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.391 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -63.24 -41.52 99.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.845 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -94.09 -5.91 46.25 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.9 tptt 62.55 21.36 12.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.402 1.481 . . . . 0.0 110.512 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.06 167.77 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.868 -173.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 61.3 m-85 -96.46 139.41 32.6 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -128.39 165.9 19.72 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -177.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -178.39 153.7 13.32 Favored Glycine 0 N--CA 1.426 -2.01 0 C-N-CA 119.353 -1.403 . . . . 0.0 112.545 175.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.488 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 8.5 mp -115.19 140.04 49.42 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 122.344 0.258 . . . . 0.0 110.429 174.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.618 ' HB ' HD13 ' A' ' 511' ' ' LEU . 3.0 tt -109.21 108.11 60.12 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-O 120.899 0.381 . . . . 0.0 111.903 177.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.52 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 31.8 Cg_exo -69.86 140.35 42.1 Favored 'Trans proline' 0 C--O 1.283 2.766 0 C-N-CA 123.637 2.891 . . . . 0.0 112.764 171.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -70.64 -44.78 66.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 113.555 -1.657 . . . . 0.0 110.316 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -85.16 101.88 12.83 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.575 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -31.98 72.59 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.956 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 18.5 m -59.3 -48.3 82.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.8 -40.36 37.01 Favored Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.179 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.507 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 34.3 t80 -70.59 -46.82 62.7 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.647 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.97 -38.89 81.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -57.54 -46.07 84.31 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.461 0.304 . . . . 0.0 110.352 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . 0.408 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -64.6 -42.05 97.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.644 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 541' ' ' ILE . 48.2 mm -66.88 -35.82 75.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 122.12 0.168 . . . . 0.0 110.945 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.1 -41.35 75.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.956 0.503 . . . . 0.0 110.144 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -63.0 -45.82 90.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.655 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 536' ' ' GLY . 55.7 t -62.4 -45.9 97.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.34 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 537' ' ' ILE . 66.7 mt -65.44 -45.43 92.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 C-N-CA 122.343 0.257 . . . . 0.0 111.42 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.6 t -67.22 -35.73 80.2 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.949 -178.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -67.73 -42.16 82.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.195 0.521 . . . . 0.0 109.787 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 46.0 tp . . . . . 0 C--O 1.211 -0.935 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.67 -178.818 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.346 0 CA-C-O 120.871 0.367 . . . . 0.0 110.028 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.94 118.48 36.92 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.281 -175.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.53 126.36 27.62 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 176.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -132.55 -46.0 0.89 Allowed 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.453 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 61.4 t90 -147.81 143.42 27.47 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.376 -176.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 43.8 t -127.44 118.05 23.31 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.453 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -163.07 -172.51 30.65 Favored Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.968 -175.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 53.3 t -113.28 141.4 29.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.304 0.642 . . . . 0.0 109.354 -176.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.9 mp -114.08 140.54 48.39 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.562 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 69.0 mt-10 -115.61 126.05 53.7 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.606 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 . . . . . 0 C--N 1.287 -2.142 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.483 -178.481 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 15.4 mmm180 . . . . . 0 N--CA 1.426 -1.628 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.562 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 5.4 p -122.42 133.39 54.62 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.259 0.349 . . . . 0.0 110.825 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 95.0 mt -133.54 126.22 19.0 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.191 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.62 135.2 14.35 Favored 'Trans proline' 0 C--O 1.249 1.053 0 C-N-CA 122.263 1.975 . . . . 0.0 110.941 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . 0.577 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 20.8 p -143.21 167.02 23.1 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.336 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -117.13 129.64 56.1 Favored 'General case' 0 N--CA 1.413 -2.29 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 47.7 t -112.16 122.61 66.76 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-O 122.431 1.11 . . . . 0.0 109.958 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -108.72 160.22 16.13 Favored 'General case' 0 N--CA 1.397 -3.078 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 25.8 m -120.87 140.75 44.04 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.026 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.269 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.526 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 25.7 t-20 -95.72 131.03 42.43 Favored 'General case' 1 C--O 1.326 5.094 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.712 179.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -27.56 131.51 0.04 OUTLIER 'General case' 0 C--O 1.244 0.808 0 O-C-N 127.288 2.867 . . . . 0.0 113.576 -170.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 111.02 -3.11 28.56 Favored Glycine 0 N--CA 1.421 -2.302 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 -173.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.524 ' HB2' ' HB3' ' A' ' 469' ' ' ARG . 12.7 tt0 -115.87 111.89 21.12 Favored 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 173.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -136.44 97.68 3.64 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -139.19 157.88 45.15 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -90.42 108.0 19.5 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 175.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -74.43 31.42 0.09 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.382 1.073 . . . . 0.0 112.973 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -66.98 -46.83 73.43 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.628 1.171 . . . . 0.0 112.721 -174.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -92.88 15.23 15.28 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.876 0.37 . . . . 0.0 111.452 -176.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 8.4 m0 -76.79 129.53 78.78 Favored Pre-proline 0 C--N 1.311 -1.072 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.74 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -70.96 163.54 38.88 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.45 2.1 . . . . 0.0 109.762 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -85.68 -6.08 59.18 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 93.8 mttt -127.73 132.79 49.55 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.5 mt -118.8 146.19 45.02 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.214 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.3 128.24 55.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 80.6 mtp -100.75 125.39 47.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.262 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -107.97 113.54 26.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 7.9 mp -85.35 124.74 32.31 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.246 0.546 . . . . 0.0 111.587 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.467 HD11 ' HE1' ' A' ' 512' ' ' MET . 22.5 pt -134.5 161.04 66.08 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.456 -177.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . 0.425 ' HD3' HD23 ' A' ' 544' ' ' LEU . 37.3 Cg_endo -72.04 128.68 14.26 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 120.064 1.059 . . . . 0.0 112.518 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -63.7 -30.36 71.47 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.623 1.169 . . . . 0.0 110.553 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.08 -36.13 82.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.892 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 540' ' ' VAL . 34.1 tp -87.29 -5.55 58.88 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.632 0.73 . . . . 0.0 111.022 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 59.1 tp -78.01 -16.12 58.36 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.791 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 22.5 p -57.59 -29.21 64.28 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 124.101 0.96 . . . . 0.0 113.101 -174.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 21.4 m -63.18 -29.75 71.04 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-O 121.102 0.477 . . . . 0.0 110.757 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.14 7.92 29.36 Favored 'General case' 0 C--O 1.222 -0.391 0 O-C-N 122.193 -0.317 . . . . 0.0 111.55 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -46.1 -58.03 5.91 Favored Glycine 0 CA--C 1.543 1.792 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.9 -22.84 75.49 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 122.672 2.248 . . . . 0.0 113.336 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.8 tp -72.43 -29.87 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.016 0.436 . . . . 0.0 109.899 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -75.22 -13.19 60.43 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.297 -0.865 . . . . 0.0 113.073 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . 0.474 ' NE ' ' HA ' ' A' ' 466' ' ' ARG . 5.0 mmp_? -61.78 -46.2 90.6 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.106 -0.638 . . . . 0.0 111.946 -177.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -95.13 84.29 4.06 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . 0.424 ' HB2' HD23 ' A' ' 525' ' ' LEU . 66.0 m -148.24 169.99 18.86 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.922 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.524 ' HB3' ' HB2' ' A' ' 437' ' ' GLU . 8.0 mtm180 -111.13 141.98 43.92 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 -175.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.545 ' HG2' ' HG ' ' A' ' 525' ' ' LEU . 47.5 mtp -99.73 152.71 19.79 Favored 'General case' 0 N--CA 1.425 -1.717 0 C-N-CA 116.837 -1.945 . . . . 0.0 110.75 -173.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 23.1 m -134.0 159.45 42.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.661 178.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -129.44 119.87 24.52 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.752 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -107.42 119.87 40.61 Favored 'General case' 0 C--O 1.29 3.199 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.296 -177.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.23 123.22 27.97 Favored 'General case' 0 N--CA 1.42 -1.96 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 174.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 41.2 m-85 . . . . . 0 C--N 1.292 -1.916 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.002 -176.471 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 20.0 mt . . . . . 0 N--CA 1.444 -0.737 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -72.23 -53.79 11.53 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.035 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 7.0 m -73.88 -47.94 34.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -172.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . 0.509 ' HB3' ' CE2' ' A' ' 487' ' ' TYR . 30.4 mt -71.07 -22.39 62.12 Favored 'General case' 0 C--O 1.19 -2.029 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -174.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -55.81 -42.65 75.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -70.0 -44.5 61.07 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.13 175.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -41.67 97.23 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 483' ' ' LEU . 7.0 m-30 -56.23 -42.36 77.14 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.393 0.677 . . . . 0.0 109.774 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.29 -48.05 79.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.197 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 68.6 mt -62.2 -50.54 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 123.577 0.548 . . . . 0.0 111.341 -178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 91.6 mmm -63.65 -43.01 98.02 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.363 0.601 . . . . 0.0 110.427 -177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -70.34 -12.8 69.88 Favored Glycine 0 CA--C 1.521 0.464 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.685 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -88.5 11.04 18.18 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.287 1.041 . . . . 0.0 109.201 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.91 30.07 6.94 Favored Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.106 177.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -113.38 145.16 41.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 117.098 0.449 . . . . 0.0 111.367 176.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -124.46 153.47 41.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -114.16 107.39 1.85 Allowed Glycine 0 N--CA 1.422 -2.24 0 C-N-CA 120.34 -0.933 . . . . 0.0 111.204 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 49.5 t -82.42 121.04 26.21 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.0 t -100.8 120.8 50.79 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.197 0 CA-C-O 121.687 0.756 . . . . 0.0 109.588 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -107.6 143.23 36.35 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.84 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -100.19 129.26 28.57 Favored Pre-proline 0 C--N 1.284 -2.268 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.61 -176.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo . . . . . 0 C--O 1.245 0.858 0 N-CA-C 107.19 -1.889 . . . . 0.0 107.19 169.175 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p . . . . . 0 N--CA 1.434 -1.241 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.484 ' HG2' ' HA ' ' A' ' 528' ' ' TYR . 4.7 mtm180 72.69 165.47 0.29 Allowed 'General case' 0 C--N 1.373 1.612 0 C-N-CA 124.853 1.261 . . . . 0.0 109.071 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 15.9 m -128.63 163.92 32.0 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.945 0 C-N-CA 117.766 -1.574 . . . . 0.0 111.404 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.551 ' HB2' HG12 ' A' ' 526' ' ' ILE . 12.3 tp -125.88 145.87 50.07 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.279 0.561 . . . . 0.0 112.346 -173.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . 0.467 ' HE1' HD11 ' A' ' 453' ' ' ILE . 38.5 tpp -115.24 117.81 31.55 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 174.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.533 HD11 ' HB3' ' A' ' 522' ' ' PHE . 48.3 tp -100.03 121.17 40.96 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 121.239 0.542 . . . . 0.0 109.995 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.17 130.02 51.81 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.45 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -90.13 127.45 36.1 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.8 p -101.46 110.76 22.81 Favored 'General case' 0 N--CA 1.401 -2.876 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 7.9 m -68.5 -34.36 75.76 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.197 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -74.46 -27.9 60.8 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.743 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -99.0 -9.89 23.37 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 120.461 -0.496 . . . . 0.0 109.861 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 59.74 31.01 20.59 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.467 1.107 . . . . 0.0 111.797 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -144.82 167.48 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.533 ' HB3' HD11 ' A' ' 513' ' ' LEU . 30.1 m-85 -102.56 138.33 39.61 Favored 'General case' 0 N--CA 1.42 -1.936 0 C-N-CA 119.321 -0.952 . . . . 0.0 110.283 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 25.8 ptm -127.01 159.57 33.73 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -165.89 153.08 22.79 Favored Glycine 0 N--CA 1.42 -2.38 0 C-N-CA 118.437 -1.839 . . . . 0.0 112.67 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.545 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 9.6 mp -115.58 139.21 50.3 Favored 'General case' 0 C--N 1.29 -1.987 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 171.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 511' ' ' LEU . 25.0 mt -105.67 107.46 59.41 Favored Pre-proline 0 N--CA 1.428 -1.558 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 25.4 Cg_exo -70.93 138.0 33.2 Favored 'Trans proline' 0 C--O 1.295 3.359 0 C-N-CA 123.027 2.485 . . . . 0.0 112.316 171.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . 0.484 ' HA ' ' HG2' ' A' ' 509' ' ' ARG . 96.9 m-85 -71.65 -41.43 68.79 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 113.3 -1.773 . . . . 0.0 110.28 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.48 89.71 3.84 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -67.5 -44.98 77.18 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.71 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.1 m -60.36 -46.85 88.47 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 112.818 0.674 . . . . 0.0 112.818 -174.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -75.85 -38.48 36.18 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.453 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 537' ' ' ILE . 46.4 t80 -63.98 -47.57 79.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 93.5 t -61.45 -38.85 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 121.09 0.471 . . . . 0.0 110.038 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -62.44 -41.18 98.55 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.352 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.99 -41.15 93.37 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 533' ' ' PHE . 46.7 mm -62.72 -35.52 71.05 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 122.757 0.423 . . . . 0.0 111.122 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -55.92 -38.59 70.46 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.05 0.452 . . . . 0.0 111.301 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -68.99 -44.27 73.2 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.301 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 457' ' ' LEU . 48.6 t -62.39 -42.26 94.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.176 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 537' ' ' ILE . 73.8 mt -60.54 -45.14 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.328 0.651 . . . . 0.0 109.708 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 60.2 m -58.7 -41.53 86.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.112 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -68.11 -42.93 79.53 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.455 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.425 HD23 ' HD3' ' A' ' 454' ' ' PRO . 2.8 tm? . . . . . 0 N--CA 1.469 0.511 0 C-N-CA 123.659 0.784 . . . . 0.0 111.726 -179.288 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . 0.424 ' HD2' ' N ' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 CA--C 1.493 -1.249 0 N-CA-C 109.647 -0.501 . . . . 0.0 109.647 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.402 ' HB2' HG23 ' A' ' 433' ' ' VAL . 2.9 mp -106.16 132.47 52.19 Favored 'General case' 0 C--N 1.265 -3.091 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -175.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.58 128.87 37.59 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -118.59 -62.88 1.48 Allowed 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.472 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 52.1 t90 -140.11 145.95 38.25 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.357 -171.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 20.6 t -126.26 121.52 32.91 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.472 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -169.56 -172.09 35.82 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.443 -175.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 49.7 t -109.55 139.23 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 448' ' ' LEU . 9.2 tp -113.91 132.2 56.01 Favored 'General case' 0 N--CA 1.409 -2.514 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -115.62 125.85 53.44 Favored 'General case' 0 N--CA 1.419 -2.012 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 . . . . . 0 C--N 1.296 -1.745 0 CA-C-O 121.04 0.447 . . . . 0.0 111.143 -171.688 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 . . . . . 0 C--O 1.211 -0.931 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 46.9 p -125.46 131.53 52.84 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.926 0.393 . . . . 0.0 111.484 -175.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 482' ' ' SER . 62.1 mt -136.16 127.38 16.94 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 122.754 0.422 . . . . 0.0 111.977 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -73.43 134.47 20.74 Favored 'Trans proline' 0 C--O 1.254 1.312 0 C-N-CA 122.385 2.056 . . . . 0.0 110.791 175.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.3 p -141.91 161.54 37.71 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.694 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -116.98 129.78 56.26 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.36 124.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.795 0 CA-C-O 121.739 0.78 . . . . 0.0 110.502 -175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -107.86 155.37 20.35 Favored 'General case' 0 C--N 1.28 -2.428 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 471' ' ' VAL . 18.1 m -122.27 139.31 49.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.635 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 37.0 t30 -98.33 130.86 45.0 Favored 'General case' 1 C--O 1.309 4.219 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.502 168.703 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.485 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 80.0 m80 -19.53 152.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 131.166 3.786 . . . . 0.0 118.201 -170.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 110.76 -1.16 28.89 Favored Glycine 0 C--O 1.244 0.769 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.488 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.567 ' HG3' HG21 ' A' ' 433' ' ' VAL . 0.0 OUTLIER -97.19 146.31 25.2 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -174.063 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -155.95 93.41 1.44 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 160.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -142.26 146.4 35.09 Favored 'General case' 0 C--N 1.281 -2.385 0 CA-C-N 114.09 -1.413 . . . . 0.0 107.539 174.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 19.4 ptmt -102.25 129.41 48.64 Favored 'General case' 0 C--N 1.282 -2.359 0 C-N-CA 118.665 -1.214 . . . . 0.0 110.185 175.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.448 HG21 ' HB2' ' A' ' 402' ' ' TRP . 8.0 p -83.56 1.15 43.46 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.086 0.946 . . . . 0.0 111.435 -175.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.08 -30.12 71.21 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.687 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 440' ' ' LYS . 4.4 pt20 -101.29 17.22 23.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.627 -176.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -95.94 141.84 23.73 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.257 177.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.85 163.04 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.187 1.925 . . . . 0.0 109.74 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . 0.308 2.7 pp0? -97.55 -7.78 30.54 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 14.0 mptt -127.88 113.77 16.33 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.786 0.834 . . . . 0.0 109.67 169.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . 0.551 ' HB2' HD12 ' A' ' 406' ' ' LEU . 50.3 mt -103.38 147.12 27.5 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 46.5 mm -99.35 122.52 51.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 120.887 0.375 . . . . 0.0 110.543 -174.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.424 ' SD ' HD23 ' A' ' 513' ' ' LEU . 57.9 ttp -112.08 121.82 46.04 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . 0.454 ' HB2' ' SG ' ' A' ' 497' ' ' CYS . 12.4 mm-40 -106.91 133.62 51.29 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 489' ' ' ILE . 88.1 mt -91.29 115.87 28.37 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.473 0.654 . . . . 0.0 111.391 -177.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.448 ' HA ' HD11 ' A' ' 544' ' ' LEU . 39.6 pt -116.9 161.76 30.79 Favored Pre-proline 0 C--N 1.311 -1.077 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.078 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . 0.451 ' HD3' HD11 ' A' ' 544' ' ' LEU . 8.4 Cg_exo -71.54 129.68 16.09 Favored 'Trans proline' 0 C--O 1.244 0.806 0 C-N-CA 121.464 1.443 . . . . 0.0 110.919 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -62.75 -28.15 69.77 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.5 0.72 . . . . 0.0 111.148 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . 0.41 ' CD ' ' H ' ' A' ' 456' ' ' GLN . 19.3 mp0 -63.89 -40.7 97.13 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.132 -176.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.8 mt -77.81 -11.47 59.89 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.198 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.1 tp -82.69 -19.33 38.32 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.0 m -58.28 -28.55 65.06 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 122.959 0.503 . . . . 0.0 111.134 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 15.7 m -61.37 -27.62 68.65 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.195 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.07 8.42 37.86 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.628 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . 0.426 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -45.96 -52.25 10.08 Favored Glycine 0 CA--C 1.545 1.933 0 N-CA-C 114.891 0.716 . . . . 0.0 114.891 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 11.8 Cg_endo -56.14 -28.62 71.3 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.88 2.387 . . . . 0.0 113.405 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 42.4 tp -75.93 -29.89 58.53 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.202 0.525 . . . . 0.0 110.762 -177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -72.99 -12.61 61.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.183 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -68.83 -20.48 64.31 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.777 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -127.21 84.66 2.28 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.334 0.588 . . . . 0.0 109.482 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.4 m -158.15 170.32 22.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 -178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -110.45 143.75 40.28 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 124.326 1.051 . . . . 0.0 109.61 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.635 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 32.2 mmm -96.39 152.06 18.95 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -165.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 433' ' ' VAL . 4.8 m -142.27 162.08 19.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -133.84 130.03 37.32 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -110.95 117.62 33.87 Favored 'General case' 0 C--O 1.274 2.389 0 CA-C-O 121.734 0.778 . . . . 0.0 111.015 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -114.51 122.71 47.4 Favored 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 173.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 . . . . . 0 C--N 1.288 -2.073 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.66 -177.462 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 79.1 mt . . . . . 0 C--O 1.214 -0.804 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -69.53 -42.33 74.79 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.275 0.559 . . . . 0.0 110.865 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . 0.484 ' HB3' HD21 ' A' ' 427' ' ' LEU . 8.5 t -72.22 -38.35 69.0 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.76 -43.78 97.89 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.276 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -55.04 -43.04 73.4 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.312 0.645 . . . . 0.0 110.587 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.499 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.96 -46.44 59.49 Favored Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 42.4 tp -58.41 -44.3 88.96 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 123.544 0.737 . . . . 0.0 111.267 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -60.35 -40.33 90.34 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 122.654 0.382 . . . . 0.0 111.16 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -66.58 -44.04 83.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.018 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 452' ' ' LEU . 66.2 mt -65.78 -44.4 93.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.159 0.504 . . . . 0.0 109.834 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.4 mmt -63.87 -43.01 97.37 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.041 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.16 -15.36 69.74 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.215 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -84.72 -4.24 58.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.396 0.617 . . . . 0.0 109.891 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.56 30.42 6.54 Favored Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.104 -1.046 . . . . 0.0 113.739 177.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -103.4 161.75 13.58 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.64 0.257 . . . . 0.0 110.342 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -127.95 153.12 47.07 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -112.31 107.53 2.07 Favored Glycine 0 N--CA 1.424 -2.152 0 C-N-CA 120.203 -0.998 . . . . 0.0 112.4 -177.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 451' ' ' GLN . 17.6 p -84.44 117.32 23.57 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.13 120.41 50.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.881 0 CA-C-O 121.962 0.887 . . . . 0.0 109.303 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -112.81 143.24 44.39 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 113.145 -1.843 . . . . 0.0 107.763 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . 0.435 ' CD2' HG11 ' A' ' 508' ' ' VAL . 15.8 m-85 -98.68 126.48 38.81 Favored Pre-proline 0 C--N 1.268 -2.969 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo . . . . . 0 C--O 1.244 0.819 0 C-N-CA 122.536 2.157 . . . . 0.0 112.992 -177.176 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.435 HG11 ' CD2' ' A' ' 500' ' ' PHE . 4.6 t . . . . . 0 N--CA 1.423 -1.82 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.624 ' HD2' ' O ' ' A' ' 528' ' ' TYR . 19.4 mmt180 -81.2 171.15 15.23 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.547 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 24.2 m -109.44 165.87 5.12 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.402 0 C-N-CA 117.966 -1.494 . . . . 0.0 112.077 -171.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.567 ' HB2' HG12 ' A' ' 526' ' ' ILE . 1.0 OUTLIER -133.01 134.42 44.42 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.118 -177.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . 0.416 ' N ' HD22 ' A' ' 511' ' ' LEU . 35.0 tpp -102.46 121.36 42.19 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.011 -0.736 . . . . 0.0 109.011 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 522' ' ' PHE . 31.8 tp -106.95 125.29 50.81 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.622 0.725 . . . . 0.0 110.523 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 59.4 mt -124.28 148.83 47.12 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.237 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -100.04 124.0 44.92 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.359 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 34.8 p -93.9 110.42 22.09 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 173.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.8 p -68.92 -35.49 76.87 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.352 -1.294 . . . . 0.0 113.061 -175.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -72.92 -24.17 60.78 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.65 0.738 . . . . 0.0 110.327 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -105.24 -9.81 17.45 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.257 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 61.09 24.13 14.26 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.736 1.214 . . . . 0.0 111.598 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -133.0 167.65 26.17 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.687 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' A' ' 513' ' ' LEU . 24.4 m-85 -102.31 138.87 38.68 Favored 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.314 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -133.81 141.63 47.53 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . 0.403 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -152.69 159.12 28.27 Favored Glycine 0 N--CA 1.431 -1.663 0 C-N-CA 118.861 -1.637 . . . . 0.0 113.465 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.55 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.6 mp -115.6 139.96 49.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 173.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 511' ' ' LEU . 12.4 mt -97.97 107.98 43.73 Favored Pre-proline 0 C--O 1.249 1.072 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 177.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 525' ' ' LEU . 23.8 Cg_exo -72.06 133.13 20.85 Favored 'Trans proline' 0 C--O 1.294 3.301 0 C-N-CA 123.231 2.621 . . . . 0.0 112.289 171.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . 0.624 ' O ' ' HD2' ' A' ' 509' ' ' ARG . 70.4 m-85 -74.89 -41.3 60.02 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.571 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -84.03 91.95 7.75 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.944 0.878 . . . . 0.0 110.184 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -37.34 83.13 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 114.201 -1.363 . . . . 0.0 113.138 179.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 22.6 t -61.0 -47.71 85.21 Favored 'General case' 0 C--O 1.243 0.763 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -175.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.68 -36.54 37.22 Favored Glycine 0 N--CA 1.437 -1.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.818 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 537' ' ' ILE . 50.2 t80 -66.22 -47.34 74.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 88.2 t -65.24 -38.36 82.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.052 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -59.17 -38.56 80.06 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.38 0.61 . . . . 0.0 110.187 176.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -70.53 -46.3 48.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 533' ' ' PHE . 51.6 mm -67.33 -36.15 75.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -56.33 -43.19 78.8 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -59.64 -40.45 87.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.647 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 56.5 t -67.28 -46.56 83.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.066 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.433 ' O ' ' HB2' ' A' ' 544' ' ' LEU . 77.0 mt -62.71 -45.25 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-O 121.302 0.572 . . . . 0.0 109.935 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 21.8 m -63.37 -33.56 75.81 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.907 177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -64.63 -44.08 91.66 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 173.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.451 HD11 ' HD3' ' A' ' 454' ' ' PRO . 96.8 mt . . . . . 0 N--CA 1.474 0.73 0 C-N-CA 123.486 0.714 . . . . 0.0 111.733 176.618 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.415 -2.18 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mp -112.6 137.05 51.42 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.59 125.14 22.92 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -111.9 -64.65 1.26 Allowed 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.09 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.587 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 69.1 t90 -161.61 150.09 15.53 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -169.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.5 m -129.47 117.82 21.13 Favored 'General case' 0 C--N 1.276 -2.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.587 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -155.1 -172.39 22.73 Favored Glycine 0 N--CA 1.424 -2.15 0 C-N-CA 119.752 -1.213 . . . . 0.0 113.152 -174.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 428' ' ' PRO . 61.6 t -109.28 140.71 26.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 84.4 mt -113.26 128.14 56.38 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -117.21 126.08 52.2 Favored 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -177.144 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 . . . . . 0 C--N 1.309 -1.162 0 C-N-CA 123.36 0.664 . . . . 0.0 110.085 -174.343 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 . . . . . 0 N--CA 1.443 -0.811 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 56.3 p -123.13 130.1 52.32 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 121.134 -0.226 . . . . 0.0 110.863 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 428' ' ' PRO . 92.5 mt -130.55 125.94 21.78 Favored Pre-proline 0 C--N 1.316 -0.861 0 O-C-N 123.192 0.308 . . . . 0.0 111.094 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 427' ' ' LEU . 8.7 Cg_exo -75.84 142.34 25.29 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.043 2.496 . . . . 0.0 112.182 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 475' ' ' PHE . 23.1 p -141.13 168.57 19.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.2 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -115.7 129.53 56.51 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 104.953 -2.239 . . . . 0.0 104.953 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.8 t -122.79 123.92 69.33 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 CA-C-O 121.874 0.845 . . . . 0.0 110.274 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . 0.474 ' HB2' ' HB3' ' A' ' 472' ' ' GLN . 78.0 m-85 -118.54 161.0 20.75 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.506 HG12 HG12 ' A' ' 471' ' ' VAL . 6.2 m -121.86 140.22 46.5 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.501 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -96.07 132.96 40.9 Favored 'General case' 0 C--O 1.297 3.553 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.267 172.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -25.15 157.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 129.94 3.296 . . . . 0.0 117.385 -171.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.08 -2.43 35.34 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -172.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.537 ' HA ' ' CZ ' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -101.77 161.46 13.64 Favored 'General case' 0 N--CA 1.406 -2.648 0 CA-C-N 113.12 -1.54 . . . . 0.0 114.584 -174.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 178.81 94.01 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 168.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -142.72 157.56 44.53 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.919 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -99.71 132.0 45.33 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.419 ' HA ' ' CD1' ' A' ' 444' ' ' TRP . 17.7 p -101.74 19.11 18.79 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.235 0.54 . . . . 0.0 111.965 -177.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -75.8 -27.53 57.98 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.511 0.672 . . . . 0.0 111.609 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -94.57 8.43 42.28 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.33 1.062 . . . . 0.0 109.855 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . 0.419 ' CD1' ' HA ' ' A' ' 441' ' ' THR . 12.7 m0 -80.18 121.1 81.46 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.468 177.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.98 149.47 70.46 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.55 2.167 . . . . 0.0 110.194 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.15 -22.53 59.4 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 123.066 0.546 . . . . 0.0 110.229 -174.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -124.35 123.84 41.08 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.555 173.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 90.2 mt -106.29 146.94 29.75 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 51.4 mm -98.53 119.12 46.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.508 ' SD ' HD23 ' A' ' 513' ' ' LEU . 54.2 ttp -113.33 129.7 56.46 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.347 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 451' ' ' GLN . 14.8 mm-40 -119.0 130.93 55.94 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.486 HD13 HG21 ' A' ' 489' ' ' ILE . 77.9 mt -84.54 123.71 30.6 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.233 -176.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 30.9 pt -128.61 158.03 73.24 Favored Pre-proline 0 C--N 1.305 -1.355 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.51 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -63.57 130.15 27.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 121.865 1.71 . . . . 0.0 111.312 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 458' ' ' LEU . 21.1 tm0? -62.3 -29.93 70.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.249 0.62 . . . . 0.0 111.667 -177.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -60.27 -31.08 69.89 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -79.29 -12.75 59.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.218 0.533 . . . . 0.0 111.096 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 455' ' ' GLN . 4.2 tt -73.74 -22.18 59.96 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 124.036 0.934 . . . . 0.0 110.938 -178.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 41.7 p -58.42 -19.72 38.64 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 14.6 t -70.76 -21.14 62.55 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.279 0.561 . . . . 0.0 110.905 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 86.4 mt -88.62 11.05 18.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.127 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.19 -58.43 5.08 Favored Glycine 0 CA--C 1.548 2.115 0 CA-C-O 119.38 -0.678 . . . . 0.0 114.469 178.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.27 -24.44 78.85 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.899 2.4 . . . . 0.0 112.693 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.0 tp -75.46 -46.44 32.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.223 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -70.69 -14.77 62.58 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -71.95 -17.13 62.1 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.813 0.339 . . . . 0.0 111.054 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -126.78 76.83 1.67 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . 0.413 ' HA ' ' CE2' ' A' ' 528' ' ' TYR . 69.3 m -152.8 170.99 18.96 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.926 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.537 ' CZ ' ' HA ' ' A' ' 437' ' ' GLU . 6.5 ptp180 -111.69 144.04 41.61 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 125.889 1.676 . . . . 0.0 109.039 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . . . . . . . . . 27.3 mmm -95.4 152.61 18.24 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.405 -167.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 524' ' ' GLY . 16.8 m -127.14 162.08 32.91 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.275 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 432' ' ' TYR . 55.8 tp60 -133.51 119.95 20.19 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.406 ' HE1' HG21 ' A' ' 471' ' ' VAL . 30.4 m-85 -115.36 126.44 54.43 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-O 121.594 0.711 . . . . 0.0 111.57 -178.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.97 123.19 26.86 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 174.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 429' ' ' CYS . 56.4 m-85 . . . . . 0 C--N 1.294 -1.82 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.83 -177.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 93.6 mt . . . . . 0 N--CA 1.446 -0.656 0 CA-C-O 120.983 0.42 . . . . 0.0 111.383 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 484' ' ' LYS . 29.3 mm-40 -71.09 -45.02 64.51 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.9 m -63.87 -37.16 86.36 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.279 0.561 . . . . 0.0 109.527 176.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . 0.517 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 85.2 mt -64.57 -36.8 85.4 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.991 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 481' ' ' GLU . 36.9 ttpt -54.44 -44.49 72.53 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.715 0.806 . . . . 0.0 110.649 -178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -69.3 -43.52 70.13 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.092 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.88 -42.48 97.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.897 0.479 . . . . 0.0 110.081 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . 0.517 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -58.49 -40.41 82.69 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.689 0.396 . . . . 0.0 111.351 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -67.28 -37.68 83.83 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.2 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.486 HG21 HD13 ' A' ' 452' ' ' LEU . 65.6 mt -68.24 -45.58 82.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.1 mmt -63.62 -37.31 86.84 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.529 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.31 -9.95 84.35 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.344 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -92.53 8.52 38.49 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.774 0.797 . . . . 0.0 109.943 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 91.61 29.66 11.74 Favored Glycine 0 C--O 1.245 0.804 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.889 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -109.24 157.03 19.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -128.24 160.51 31.89 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -118.15 109.1 1.74 Allowed Glycine 0 N--CA 1.421 -2.319 0 C-N-CA 120.004 -1.094 . . . . 0.0 111.461 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 19.6 p -82.39 120.55 25.58 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.6 t -102.35 120.2 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.723 0 CA-C-O 121.489 0.661 . . . . 0.0 109.411 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . 0.4 ' NE2' HG22 ' A' ' 534' ' ' VAL . 42.3 m80 -112.01 137.48 49.97 Favored 'General case' 0 N--CA 1.418 -2.044 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.783 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -98.95 114.81 65.83 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.535 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo . . . . . 0 N--CA 1.457 -0.662 0 C-N-CA 122.153 1.902 . . . . 0.0 108.593 175.998 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 33.6 t . . . . . 0 N--CA 1.431 -1.385 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.402 ' H ' ' NE ' ' A' ' 509' ' ' ARG . 0.1 OUTLIER -56.75 150.83 15.28 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 124.268 0.98 . . . . 0.0 110.389 -175.82 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.563 ' O ' HG13 ' A' ' 526' ' ' ILE . 12.5 m -118.33 159.03 19.02 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.734 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 6.4 tt -135.35 147.11 48.99 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.119 -1.032 . . . . 0.0 112.747 -167.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 53.2 tpp -106.42 124.62 49.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -104.17 127.31 51.76 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.536 0.684 . . . . 0.0 110.354 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -130.72 148.68 52.54 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.664 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -102.37 129.13 48.75 Favored 'General case' 0 C--N 1.277 -2.548 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 176.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.7 t -104.92 110.7 23.18 Favored 'General case' 0 N--CA 1.414 -2.246 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 11.7 t -69.73 -22.43 63.38 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.165 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -62.66 -43.38 98.96 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.945 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.02 -4.75 24.18 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.306 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 59.99 30.02 19.55 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.616 1.166 . . . . 0.0 111.492 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -140.96 168.71 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.948 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.651 ' HB3' HD11 ' A' ' 513' ' ' LEU . 44.3 m-85 -96.41 139.26 32.78 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -138.05 166.51 23.92 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 123.689 0.796 . . . . 0.0 109.485 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . 0.509 ' O ' HG22 ' A' ' 471' ' ' VAL . . . 178.86 167.29 36.25 Favored Glycine 0 N--CA 1.42 -2.369 0 C-N-CA 119.135 -1.507 . . . . 0.0 111.745 178.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.451 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.1 mp -114.94 140.66 48.83 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 170.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.563 HG13 ' O ' ' A' ' 510' ' ' VAL . 6.7 tt -103.38 107.86 57.22 Favored Pre-proline 0 C--N 1.299 -1.599 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.568 175.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.557 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 32.5 Cg_exo -66.33 132.21 28.81 Favored 'Trans proline' 0 C--O 1.282 2.689 0 C-N-CA 123.315 2.677 . . . . 0.0 113.286 172.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . 0.43 ' HE1' ' CZ ' ' A' ' 469' ' ' ARG . 43.3 m-85 -72.26 -38.98 68.73 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 113.175 -1.83 . . . . 0.0 109.094 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.35 87.29 6.6 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.428 -174.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.9 pp0? -66.61 -34.53 78.1 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.741 -179.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.8 p -58.92 -46.45 87.91 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.467 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.65 -34.76 52.98 Favored Glycine 0 N--CA 1.429 -1.774 0 CA-C-N 116.292 -0.413 . . . . 0.0 113.254 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.494 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 73.5 t80 -70.54 -47.64 59.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.295 0.548 . . . . 0.0 110.556 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . 0.4 HG22 ' NE2' ' A' ' 499' ' ' HIS . 99.1 t -64.79 -37.82 81.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.002 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -59.54 -48.17 82.7 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.58 89.16 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.283 -0.484 . . . . 0.0 112.197 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.42 ' O ' HG13 ' A' ' 541' ' ' ILE . 39.9 mm -68.27 -22.15 27.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.619 -0.291 . . . . 0.0 111.326 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -60.58 -40.44 91.69 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.12 -0.363 . . . . 0.0 110.657 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.81 -38.02 89.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.94 -49.96 77.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.854 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 537' ' ' ILE . 81.8 mt -60.68 -45.96 96.66 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 123.18 0.592 . . . . 0.0 111.676 -178.295 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.7 t -65.93 -38.49 88.79 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.262 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.7 -41.4 79.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.246 176.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 CA--C 1.541 0.635 0 C-N-CA 122.92 0.488 . . . . 0.0 110.361 -178.701 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.434 -1.231 0 CA-C-O 121.094 0.473 . . . . 0.0 111.345 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 4.3 mp -101.98 137.66 39.97 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.063 -175.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.25 115.45 7.72 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 175.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.66 -54.59 2.47 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.548 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 74.4 t90 -159.45 144.95 15.87 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.187 -171.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 45.7 m -130.0 120.89 25.49 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 174.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.548 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -156.48 -171.67 22.98 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -174.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -121.28 142.57 36.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-N 116.909 0.354 . . . . 0.0 110.148 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.665 HD13 ' SG ' ' A' ' 429' ' ' CYS . 9.8 mp -112.76 139.06 48.7 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.442 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 65.5 mt-10 -115.02 152.43 32.46 Favored 'General case' 0 C--O 1.254 1.34 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.443 0 C-N-CA 125.972 1.709 . . . . 0.0 108.997 -178.231 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 40.0 mmt180 . . . . . 0 N--CA 1.422 -1.872 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.442 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 57.5 p -144.48 159.76 42.22 Favored 'General case' 0 C--N 1.259 -3.357 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.208 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . 0.425 HD21 HD23 ' A' ' 483' ' ' LEU . 22.6 tp -146.55 117.36 4.72 Favored Pre-proline 0 N--CA 1.412 -2.367 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.51 132.29 23.42 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.61 2.207 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . 0.665 ' SG ' HD13 ' A' ' 406' ' ' LEU . 0.0 OUTLIER -125.8 157.73 36.78 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.011 -175.515 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -116.89 128.92 55.71 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 170.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 28.5 t -120.33 122.98 69.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.899 0 CA-C-O 122.137 0.97 . . . . 0.0 110.218 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.09 155.09 26.61 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 471' ' ' VAL . 26.2 m -122.33 140.74 45.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.405 0 C-N-CA 119.739 -0.785 . . . . 0.0 111.264 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.65 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 27.0 t-20 -95.2 132.24 40.37 Favored 'General case' 1 C--O 1.324 4.998 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.337 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -34.35 161.42 0.0 OUTLIER 'General case' 0 C--N 1.361 1.1 0 O-C-N 127.824 3.203 . . . . 0.0 116.66 -171.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 106.59 -3.01 36.61 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -174.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -99.65 161.9 13.34 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.601 1.16 . . . . 0.0 113.978 -174.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -165.25 95.66 0.67 Allowed 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 165.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -140.81 141.49 34.73 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.071 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -96.45 118.2 32.46 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 402' ' ' TRP . 43.5 p -81.21 5.19 17.76 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.784 0.802 . . . . 0.0 111.099 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -59.04 -32.0 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.907 1.283 . . . . 0.0 109.943 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -90.81 4.58 51.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.297 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 18.4 m0 -92.78 126.25 52.43 Favored Pre-proline 0 C--N 1.308 -1.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.855 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.19 162.93 33.7 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.303 2.002 . . . . 0.0 110.474 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -75.58 -26.31 57.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 120.836 0.35 . . . . 0.0 111.044 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -113.98 130.95 56.49 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.666 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 39.4 mt -118.84 147.83 43.52 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.206 176.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 58.3 mt -98.33 123.64 50.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 65.8 ttp -100.47 132.54 45.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -124.25 115.91 21.81 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.459 HD13 HG21 ' A' ' 489' ' ' ILE . 89.2 mt -88.55 116.25 26.66 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.328 0.585 . . . . 0.0 110.728 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.0 pt -119.87 161.66 37.02 Favored Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 125.033 1.333 . . . . 0.0 108.52 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -67.48 129.58 20.46 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 121.393 1.395 . . . . 0.0 111.008 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -62.58 -36.59 83.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 123.789 0.836 . . . . 0.0 111.566 -174.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -66.35 -20.93 66.22 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.473 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.92 -3.92 59.13 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 122.144 -0.348 . . . . 0.0 111.507 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.5 tp -82.06 -16.23 50.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.201 0.524 . . . . 0.0 110.99 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 31.4 m -57.49 -25.68 60.15 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.068 0.947 . . . . 0.0 112.805 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 16.7 p -70.55 -18.97 62.93 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.763 -0.586 . . . . 0.0 111.795 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 92.9 mt -99.75 10.54 41.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.299 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -47.88 -54.98 10.43 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-O 119.399 -0.667 . . . . 0.0 114.038 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.98 -20.19 59.1 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 122.759 2.306 . . . . 0.0 113.272 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.81 -35.65 43.86 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -69.39 -13.06 62.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.323 0.649 . . . . 0.0 112.379 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -57.57 -30.46 65.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -127.02 97.12 4.83 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . 0.561 ' HB2' HD23 ' A' ' 525' ' ' LEU . 75.1 m -156.46 172.1 19.12 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 123.66 0.784 . . . . 0.0 110.013 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 437' ' ' GLU . 48.8 mtm180 -109.42 142.06 40.94 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.65 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 71.0 mmm -96.37 142.43 28.5 Favored 'General case' 0 CA--C 1.492 -1.264 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.19 -168.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 433' ' ' VAL . 4.9 m -131.59 153.56 38.98 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -132.08 127.04 35.24 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 24.3 m-85 -111.47 125.9 54.38 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.347 -177.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -130.04 127.77 40.6 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 172.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . 0.503 ' HB2' HD21 ' A' ' 483' ' ' LEU . 90.5 m-85 . . . . . 0 C--N 1.295 -1.789 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 483' ' ' LEU . 63.4 mt . . . . . 0 C--O 1.211 -0.932 0 N-CA-C 112.329 0.492 . . . . 0.0 112.329 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -61.11 -51.28 69.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.027 0.205 . . . . 0.0 110.753 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 30.2 m -64.06 -36.67 84.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . 0.503 HD21 ' HB2' ' A' ' 475' ' ' PHE . 79.0 mt -69.1 -48.89 61.43 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.66 -45.41 73.85 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.293 1.037 . . . . 0.0 111.101 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.464 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.83 -44.92 66.76 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.57 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -62.66 -43.66 98.24 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -58.38 -42.48 87.16 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.244 0.618 . . . . 0.0 110.513 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -67.72 -44.62 77.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.96 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 485' ' ' GLY . 72.9 mt -64.44 -47.9 87.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . 0.45 ' HB3' ' HB3' ' A' ' 515' ' ' TYR . 17.5 mmt -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.787 0.327 . . . . 0.0 111.086 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.04 -15.09 69.14 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.606 -178.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -85.46 2.5 44.34 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.687 0.795 . . . . 0.0 109.712 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.36 30.92 6.36 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 119.452 -1.356 . . . . 0.0 112.774 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -111.63 162.22 15.41 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 122.603 -0.351 . . . . 0.0 110.843 176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -133.73 158.84 42.28 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.48 107.17 1.32 Allowed Glycine 0 N--CA 1.422 -2.245 0 C-N-CA 119.968 -1.111 . . . . 0.0 112.074 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 38.7 t -85.91 121.52 28.66 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . 0.415 ' HB ' ' HG ' ' A' ' 511' ' ' LEU . 73.2 t -102.21 120.57 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 122.078 0.942 . . . . 0.0 109.896 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . 0.44 ' NE2' HG22 ' A' ' 534' ' ' VAL . 29.9 m80 -110.09 143.22 40.46 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.591 -178.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -99.03 141.73 23.39 Favored Pre-proline 0 C--N 1.266 -3.042 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo . . . . . 0 C--O 1.247 0.955 0 C-N-CA 121.85 1.7 . . . . 0.0 108.519 171.623 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.417 -2.123 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 528' ' ' TYR . 6.6 mpt_? -116.45 174.37 6.1 Favored 'General case' 0 C--N 1.281 -2.413 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.9 m -126.84 164.09 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 C-N-CA 118.687 -1.205 . . . . 0.0 108.266 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.554 ' HB3' HG12 ' A' ' 526' ' ' ILE . 1.3 pp -137.74 151.02 47.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 117.111 -1.836 . . . . 0.0 111.92 -175.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . 0.501 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 35.4 tpp -104.77 134.59 47.65 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 522' ' ' PHE . 58.1 tp -119.39 120.34 36.61 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 123.399 0.68 . . . . 0.0 109.994 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 62.5 mt -129.03 146.12 51.08 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.301 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.45 ' HB3' ' HB3' ' A' ' 490' ' ' MET . 33.5 t80 -99.09 123.57 43.48 Favored 'General case' 0 C--N 1.282 -2.361 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 178.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . 0.443 ' OG ' ' HD3' ' A' ' 519' ' ' LYS . 38.3 t -99.24 111.16 23.6 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 174.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 40.5 m -67.83 -29.25 68.36 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.416 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -75.02 -40.41 60.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.322 0.582 . . . . 0.0 109.694 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . 0.443 ' HD3' ' OG ' ' A' ' 516' ' ' SER . 3.8 mptp? -85.83 -9.91 56.26 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.22 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.4 tptt 63.5 24.28 14.0 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.206 1.402 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.37 167.73 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.961 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 30.9 m-85 -97.09 139.02 33.71 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 56.4 ttp -138.94 148.66 43.83 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -160.55 170.82 36.6 Favored Glycine 0 N--CA 1.421 -2.34 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.589 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.561 HD23 ' HB2' ' A' ' 468' ' ' SER . 7.3 mp -115.59 139.98 49.6 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.554 HG12 ' HB3' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -103.59 108.08 58.25 Favored Pre-proline 0 C--N 1.298 -1.667 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.862 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 37.5 Cg_exo -69.07 133.6 27.26 Favored 'Trans proline' 0 C--O 1.295 3.327 0 C-N-CA 123.852 3.035 . . . . 0.0 114.504 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . 0.58 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 49.4 m-85 -65.68 -45.38 83.08 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 112.541 -2.118 . . . . 0.0 111.776 -176.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -99.51 119.09 37.47 Favored 'General case' 0 CA--C 1.491 -1.327 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.844 -173.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -66.56 -41.86 87.98 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.349 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 44.3 t -65.91 -48.07 72.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -65.57 -43.6 94.25 Favored Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 121.404 -0.427 . . . . 0.0 112.802 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.15 -47.4 57.98 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.436 -177.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . 0.44 HG22 ' NE2' ' A' ' 499' ' ' HIS . 93.7 t -64.62 -38.98 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 110.601 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -61.49 -36.78 81.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.284 0.564 . . . . 0.0 110.172 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.93 -46.4 37.18 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.018 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 31.4 mm -64.25 -28.15 44.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.423 0.689 . . . . 0.0 111.521 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -55.55 -39.37 70.53 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 122.887 0.475 . . . . 0.0 110.626 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -65.35 -40.98 94.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 43.1 t -63.4 -42.63 96.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.553 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.1 -46.31 96.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 38.9 m -61.59 -42.18 98.5 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.71 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -64.39 -43.41 94.52 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.5 tp . . . . . 0 C--O 1.242 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 110.537 177.779 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.426 -1.63 0 CA-C-O 121.313 0.577 . . . . 0.0 110.29 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.545 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.0 mp -95.05 132.62 39.74 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.857 -172.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.09 118.83 15.45 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.87 -52.72 2.77 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -172.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.492 ' HB2' HG21 ' A' ' 441' ' ' THR . 65.2 t90 -154.57 149.89 27.15 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.266 -171.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 22.8 t -131.81 130.05 41.28 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.461 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -162.33 -172.79 30.22 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -177.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.1 t -113.22 139.29 39.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 426' ' ' SER . 72.8 mt -113.92 140.96 47.95 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.64 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 58.5 mt-10 -115.37 126.28 54.23 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 58.6 p-90 . . . . . 0 C--N 1.297 -1.701 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -173.539 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 16.2 mmm180 . . . . . 0 N--CA 1.43 -1.426 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.64 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 33.8 p -141.86 138.44 32.13 Favored 'General case' 0 N--CA 1.414 -2.254 0 O-C-N 123.459 0.475 . . . . 0.0 110.495 -175.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 96.8 mt -137.25 118.15 10.78 Favored Pre-proline 0 C--N 1.293 -1.883 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.695 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.27 138.62 56.55 Favored 'Trans proline' 0 C--O 1.249 1.056 0 C-N-CA 122.7 2.267 . . . . 0.0 109.542 170.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . 0.506 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 12.5 p -144.98 165.42 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -175.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -116.45 133.25 56.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.9 t -121.45 124.16 71.22 Favored 'Isoleucine or valine' 0 C--O 1.259 1.564 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.459 -174.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -105.25 160.81 14.81 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 175.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 471' ' ' VAL . 15.5 m -121.97 140.57 45.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 175.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.538 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 27.1 t-20 -96.16 132.18 41.85 Favored 'General case' 1 C--O 1.316 4.565 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.28 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.545 ' CD2' HD11 ' A' ' 399' ' ' LEU . 77.0 m-70 -33.0 160.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 O-C-N 128.305 3.503 . . . . 0.0 116.438 -170.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.74 -1.27 30.44 Favored Glycine 0 CA--C 1.497 -1.06 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.48 161.66 13.49 Favored 'General case' 0 C--N 1.289 -2.039 0 C-N-CA 126.194 1.798 . . . . 0.0 115.121 -172.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -159.36 98.88 1.44 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 168.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . 0.403 HD12 ' CZ2' ' A' ' 444' ' ' TRP . 1.9 pt? -139.19 139.38 37.5 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.732 -0.605 . . . . 0.0 112.163 -175.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -103.07 106.6 17.15 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 402' ' ' TRP . 25.2 p -80.28 -2.79 46.67 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 122.215 1.007 . . . . 0.0 112.435 -175.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.13 -14.22 60.94 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.225 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -101.45 9.61 41.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . 0.403 ' CZ2' HD12 ' A' ' 439' ' ' LEU . 33.7 m0 -99.08 140.64 21.85 Favored Pre-proline 0 C--O 1.247 0.945 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.368 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.64 153.99 64.54 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.877 1.718 . . . . 0.0 109.816 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -81.0 -5.16 57.25 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 92.3 mttt -132.21 126.21 33.0 Favored 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.341 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 500' ' ' PHE . 73.5 mt -118.6 146.99 44.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 63.4 mt -105.02 125.97 59.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.501 -177.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.408 ' HB2' HG22 ' A' ' 498' ' ' VAL . 48.5 ttp -106.79 118.02 35.58 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.426 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -99.86 127.04 46.06 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 175.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . 0.55 HD13 HG21 ' A' ' 489' ' ' ILE . 29.6 mt -86.67 136.79 32.9 Favored 'General case' 0 C--N 1.28 -2.413 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.31 161.27 60.14 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.83 129.09 16.92 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.348 1.366 . . . . 0.0 111.234 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.37 -25.13 68.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.916 0.886 . . . . 0.0 111.77 -177.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -58.76 -37.04 75.37 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 120.851 0.358 . . . . 0.0 110.976 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 7.7 mp -83.3 3.21 32.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.298 0.57 . . . . 0.0 111.42 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.95 -16.45 61.53 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.882 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 18.8 p -58.74 -30.62 67.62 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.854 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 7.5 m -71.27 -18.81 62.41 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.538 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.02 5.28 38.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 122.106 -0.371 . . . . 0.0 111.806 -175.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.3 -55.44 3.04 Favored Glycine 0 CA--C 1.559 2.781 0 CA-C-N 114.854 -1.067 . . . . 0.0 115.304 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.23 -26.43 76.5 Favored 'Trans proline' 0 C--N 1.368 1.588 0 C-N-CA 123.405 2.737 . . . . 0.0 114.011 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.77 -46.12 66.51 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -72.64 -14.72 61.66 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.215 -178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -70.47 -24.77 62.92 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.357 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -122.2 85.04 2.35 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . 0.439 ' HB2' HD23 ' A' ' 525' ' ' LEU . 53.2 m -151.73 163.04 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.639 0.733 . . . . 0.0 112.657 -175.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.37 142.91 41.4 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 126.28 1.832 . . . . 0.0 106.458 177.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.538 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 1.9 mmm -96.66 151.33 19.73 Favored 'General case' 0 CA--C 1.487 -1.447 0 C-N-CA 118.439 -1.305 . . . . 0.0 110.976 -168.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 433' ' ' VAL . 35.9 m -135.21 154.34 35.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 C-N-CA 123.695 0.798 . . . . 0.0 109.239 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -134.14 123.64 24.74 Favored 'General case' 0 C--N 1.285 -2.215 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.455 ' CE2' HD11 ' A' ' 406' ' ' LEU . 25.6 m-85 -107.91 133.4 52.3 Favored 'General case' 0 C--O 1.278 2.564 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.901 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -131.03 123.63 29.13 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 172.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . 0.506 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 98.4 m-85 . . . . . 0 C--N 1.305 -1.356 0 O-C-N 123.091 0.244 . . . . 0.0 110.545 -177.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 83.4 mt . . . . . 0 N--CA 1.448 -0.533 0 N-CA-C 113.478 0.918 . . . . 0.0 113.478 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -69.52 -36.94 76.88 Favored 'General case' 0 C--N 1.31 -1.138 0 O-C-N 122.963 0.164 . . . . 0.0 111.248 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 66.6 m -67.42 -40.04 85.52 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.632 174.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . 0.411 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 3.7 mm? -63.76 -45.93 87.59 Favored 'General case' 0 C--O 1.206 -1.214 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.739 176.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -55.21 -45.68 75.91 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.811 0.444 . . . . 0.0 110.611 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.414 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.44 -44.23 74.38 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.033 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -63.72 -43.81 95.45 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.438 0.695 . . . . 0.0 109.883 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 10.3 m-85 -56.91 -42.52 80.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.961 0.504 . . . . 0.0 111.053 177.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 492' ' ' ASN . 55.5 mtp180 -67.26 -44.57 79.05 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.816 178.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.55 HG21 HD13 ' A' ' 452' ' ' LEU . 75.4 mt -61.04 -48.18 90.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 O-C-N 123.396 0.435 . . . . 0.0 110.688 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 20.7 mmt -63.64 -46.63 84.78 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -68.5 -20.61 73.87 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.408 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 488' ' ' ARG . 4.0 t30 -80.78 0.24 35.65 Favored 'General case' 0 C--O 1.245 0.866 0 CA-C-O 121.551 0.691 . . . . 0.0 110.197 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.99 31.09 6.4 Favored Glycine 0 N--CA 1.439 -1.128 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.384 177.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -109.88 162.22 14.7 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 122.36 -0.494 . . . . 0.0 110.396 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -135.93 150.17 49.2 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -111.63 111.72 2.97 Favored Glycine 0 N--CA 1.43 -1.731 0 C-N-CA 119.482 -1.342 . . . . 0.0 113.031 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.06 115.55 22.94 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 176.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . 0.408 HG22 ' HB2' ' A' ' 450' ' ' MET . 47.6 t -101.48 120.85 51.65 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 CA-C-O 121.575 0.702 . . . . 0.0 109.535 -175.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -111.5 139.82 46.61 Favored 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.086 -1.416 . . . . 0.0 110.508 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . 0.411 ' HA ' HD22 ' A' ' 448' ' ' LEU . 2.4 m-85 -102.21 133.43 20.62 Favored Pre-proline 0 C--N 1.292 -1.894 0 CA-C-N 113.915 -1.493 . . . . 0.0 108.761 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo . . . . . 0 C--O 1.255 1.345 0 N-CA-C 107.815 -1.648 . . . . 0.0 107.815 167.012 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 13.9 p . . . . . 0 C--O 1.241 0.611 0 N-CA-C 109.255 -0.646 . . . . 0.0 109.255 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 31.8 mtt180 73.42 169.07 0.31 Allowed 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.249 1.42 . . . . 0.0 109.614 175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.544 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 16.0 m -131.1 163.91 35.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.903 -174.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.505 ' HB3' HG12 ' A' ' 526' ' ' ILE . 3.3 pp -138.33 154.96 48.98 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 118.068 -1.453 . . . . 0.0 110.541 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 41.3 ttm -117.25 130.1 56.34 Favored 'General case' 0 C--N 1.295 -1.772 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.534 173.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 522' ' ' PHE . 34.9 tp -95.63 129.78 42.72 Favored 'General case' 0 N--CA 1.411 -2.404 0 O-C-N 124.018 0.824 . . . . 0.0 108.991 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 64.4 mt -133.02 148.84 52.23 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.326 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -100.05 121.9 42.09 Favored 'General case' 0 C--N 1.271 -2.822 0 O-C-N 122.233 -0.292 . . . . 0.0 110.477 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 37.9 t -95.23 109.43 21.54 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.0 m -68.81 -35.41 76.96 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.733 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -69.6 -31.34 69.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.276 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -97.59 -9.99 25.97 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.842 0.353 . . . . 0.0 110.4 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 59.57 35.89 22.68 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 124.35 1.06 . . . . 0.0 111.413 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -143.01 167.5 14.07 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB3' HD11 ' A' ' 513' ' ' LEU . 52.5 m-85 -98.83 138.57 35.78 Favored 'General case' 0 N--CA 1.413 -2.305 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.901 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.4 ptm -127.06 165.88 18.65 Favored 'General case' 0 C--N 1.284 -2.274 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.19 150.88 15.34 Favored Glycine 0 N--CA 1.41 -3.047 0 C-N-CA 119.054 -1.546 . . . . 0.0 112.055 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.479 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.8 mp -114.29 140.24 48.76 Favored 'General case' 0 C--N 1.273 -2.743 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.505 HG12 ' HB3' ' A' ' 511' ' ' LEU . 7.3 mt -99.24 108.05 47.89 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 123.793 0.683 . . . . 0.0 110.812 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 34.2 Cg_exo -68.69 131.2 22.23 Favored 'Trans proline' 0 C--O 1.295 3.348 0 C-N-CA 122.102 1.868 . . . . 0.0 110.963 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -74.63 -41.57 60.14 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.389 -1.732 . . . . 0.0 110.27 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -73.85 84.89 1.7 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.995 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -66.37 -43.79 84.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.127 -179.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 15.2 m -61.34 -44.0 97.92 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.31 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -68.56 -44.86 70.09 Favored Glycine 0 C--O 1.243 0.713 0 C-N-CA 121.171 -0.537 . . . . 0.0 112.866 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.495 ' CE2' HG13 ' A' ' 537' ' ' ILE . 67.6 t80 -67.4 -48.27 67.85 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 122.126 0.17 . . . . 0.0 111.117 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.2 -37.94 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 O-C-N 123.187 0.304 . . . . 0.0 110.567 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -58.2 -46.91 84.99 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.039 0.447 . . . . 0.0 110.383 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.95 -43.38 49.65 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.706 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 541' ' ' ILE . 32.8 mm -62.03 -36.24 73.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 122.383 0.273 . . . . 0.0 111.56 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -60.65 -35.4 76.1 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.202 0.525 . . . . 0.0 110.672 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.07 -37.71 75.55 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.31 -37.94 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.642 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.55 HG12 ' O ' ' A' ' 537' ' ' ILE . 43.8 mm -60.39 -45.68 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 92.4 m -59.68 -42.93 94.03 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.658 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -67.43 -37.29 82.81 Favored 'General case' 0 C--O 1.203 -1.39 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.558 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 541' ' ' ILE . 51.9 tp . . . . . 0 C--N 1.315 -0.92 0 C-N-CA 124.197 0.999 . . . . 0.0 111.372 178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.328 0 CA-C-O 121.507 0.67 . . . . 0.0 112.375 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.475 HD11 ' ND1' ' A' ' 435' ' ' HIS . 3.2 mp -115.25 137.47 52.0 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 171.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.46 121.7 17.51 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.39 -57.08 2.13 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.503 ' HB2' HG21 ' A' ' 441' ' ' THR . 61.2 t90 -153.37 145.36 23.66 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 120.895 0.379 . . . . 0.0 111.188 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 25.0 p -119.72 126.91 52.22 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.45 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -165.47 -172.23 32.64 Favored Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.328 -176.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 59.5 t -113.19 135.54 52.37 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -177.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 448' ' ' LEU . 15.7 tp -113.94 136.81 52.48 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.481 ' HG2' ' CB ' ' A' ' 426' ' ' SER . 51.6 mt-10 -114.54 133.87 55.46 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 51.1 p-90 . . . . . 0 C--N 1.295 -1.781 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.352 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 42.4 mmt180 . . . . . 0 N--CA 1.411 -2.405 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.481 ' CB ' ' HG2' ' A' ' 407' ' ' GLU . 1.0 OUTLIER -137.85 130.14 29.17 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -177.315 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 90.3 mt -131.47 126.73 21.34 Favored Pre-proline 0 C--N 1.294 -1.809 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -60.23 138.71 83.06 Favored 'Trans proline' 0 C--O 1.249 1.03 0 C-N-CA 122.286 1.991 . . . . 0.0 110.742 172.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.6 p -145.95 157.4 43.89 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.038 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -117.36 129.37 55.83 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 46.5 t -113.67 124.2 70.08 Favored 'Isoleucine or valine' 0 C--O 1.257 1.469 0 CA-C-O 121.732 0.777 . . . . 0.0 111.129 -173.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.54 161.34 15.15 Favored 'General case' 0 C--N 1.28 -2.415 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.321 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 471' ' ' VAL . 6.1 m -119.79 140.71 42.92 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 174.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.633 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 26.8 t-20 -94.06 130.13 40.32 Favored 'General case' 1 C--O 1.339 5.809 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 171.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.475 ' ND1' HD11 ' A' ' 399' ' ' LEU . 0.5 OUTLIER -47.53 165.05 0.03 OUTLIER 'General case' 0 C--N 1.357 0.893 0 O-C-N 128.931 3.894 . . . . 0.0 115.372 -162.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . 0.449 ' H ' ' CD2' ' A' ' 435' ' ' HIS . . . 110.14 -2.98 29.88 Favored Glycine 0 N--CA 1.423 -2.168 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -172.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -132.38 159.59 38.79 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.558 -174.403 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -152.57 98.67 2.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 170.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . 0.542 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -118.82 158.53 25.45 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.947 0.403 . . . . 0.0 111.91 -177.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -102.14 118.13 36.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.503 HG21 ' HB2' ' A' ' 402' ' ' TRP . 20.2 p -95.97 8.0 44.85 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.346 1.069 . . . . 0.0 109.626 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.81 -22.84 66.59 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.205 -1.362 . . . . 0.0 111.412 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -107.47 17.27 22.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.036 0.446 . . . . 0.0 111.532 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -91.17 136.03 27.7 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.433 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -64.43 158.75 47.65 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.156 1.904 . . . . 0.0 109.469 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.02 -7.09 59.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.123 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 88.8 mttt -128.5 130.38 47.41 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 122.756 0.422 . . . . 0.0 110.59 176.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 406' ' ' LEU . 83.8 mt -119.16 147.27 44.38 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 43.9 mm -99.22 120.54 48.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.462 ' SD ' HD23 ' A' ' 513' ' ' LEU . 56.2 ttp -111.96 119.28 37.96 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.067 0.46 . . . . 0.0 111.333 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -104.9 133.16 50.17 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.02 122.09 29.56 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 120.969 0.414 . . . . 0.0 111.0 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 pt -129.77 157.81 75.58 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.676 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.41 129.34 29.3 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 121.832 1.688 . . . . 0.0 113.134 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.74 -25.46 68.21 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.197 0.999 . . . . 0.0 111.57 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -57.62 -41.49 81.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.584 0.753 . . . . 0.0 111.742 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.04 5.58 21.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.133 -172.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.97 -27.21 36.09 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.599 -178.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -31.43 67.08 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -174.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.7 m -72.46 -17.85 61.73 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.364 0.666 . . . . 0.0 112.439 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 10.8 tp -85.6 11.12 11.41 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.304 0.642 . . . . 0.0 111.318 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -37.6 -54.54 1.77 Allowed Glycine 0 CA--C 1.545 1.966 0 N-CA-C 116.667 1.427 . . . . 0.0 116.667 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.21 -40.67 51.54 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 123.07 2.513 . . . . 0.0 113.424 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.76 -30.45 70.67 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.201 0.524 . . . . 0.0 111.355 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -78.07 -13.11 59.99 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.444 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -74.78 -43.33 55.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.621 175.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . 0.401 ' O ' ' HA ' ' A' ' 527' ' ' PRO . 9.8 p-10 -95.54 74.2 3.24 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 122.025 0.917 . . . . 0.0 110.057 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -142.32 169.85 16.81 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.95 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.542 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 14.3 ptp180 -139.63 143.79 37.37 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 127.529 2.332 . . . . 0.0 105.724 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.633 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 62.1 mtp -97.23 153.12 18.22 Favored 'General case' 0 CA--C 1.483 -1.599 0 C-N-CA 115.982 -2.287 . . . . 0.0 111.875 -167.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 433' ' ' VAL . 34.8 m -133.03 159.76 42.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.993 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.28 121.39 21.21 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 14.1 m-85 -107.3 117.65 34.65 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.198 -177.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -111.87 122.27 47.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 . . . . . 0 C--N 1.303 -1.456 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.532 -176.08 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 90.2 mt . . . . . 0 C--O 1.211 -0.96 0 N-CA-C 112.346 0.499 . . . . 0.0 112.346 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -69.91 -41.5 74.58 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 120.809 0.337 . . . . 0.0 111.211 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 35.7 m -63.67 -35.31 80.12 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.749 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 93.5 mt -73.03 -51.41 18.26 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.04 178.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -55.33 -36.77 66.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.193 0.597 . . . . 0.0 111.628 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -60.51 -50.83 63.26 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.02 -42.8 89.15 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 123.251 0.62 . . . . 0.0 110.772 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -58.26 -45.51 87.69 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.18 0.592 . . . . 0.0 110.295 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -65.41 -38.57 90.35 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.391 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 485' ' ' GLY . 80.4 mt -68.21 -50.38 58.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.988 0.423 . . . . 0.0 110.572 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . 0.488 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 91.8 mtp -70.72 -35.79 72.89 Favored 'General case' 0 C--N 1.312 -1.039 0 O-C-N 122.134 -0.354 . . . . 0.0 111.592 -176.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.76 -18.66 70.56 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -81.92 6.84 14.61 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.869 0.842 . . . . 0.0 110.107 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.35 29.73 6.94 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.529 -0.843 . . . . 0.0 113.015 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -112.45 158.67 19.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -129.28 160.14 33.92 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -115.1 115.81 3.55 Favored Glycine 0 N--CA 1.417 -2.599 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.6 t -92.74 118.89 31.55 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . 0.446 HG22 ' HB2' ' A' ' 450' ' ' MET . 78.0 t -101.66 120.78 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 CA-C-O 121.361 0.6 . . . . 0.0 110.151 -178.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . 0.505 ' NE2' HG22 ' A' ' 534' ' ' VAL . 27.1 m80 -109.36 140.46 43.02 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.41 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -104.06 125.89 33.21 Favored Pre-proline 0 C--N 1.292 -1.934 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.535 -175.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo . . . . . 0 N--CA 1.459 -0.501 0 C-N-CA 121.902 1.735 . . . . 0.0 108.351 172.168 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 32.3 t . . . . . 0 N--CA 1.437 -1.099 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 20.4 mtm-85 72.82 177.08 0.26 Allowed 'General case' 0 C--N 1.371 1.51 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.274 177.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 5.6 m -133.83 162.33 39.58 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.664 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 526' ' ' ILE . 0.9 OUTLIER -134.19 136.52 43.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.08 0.854 . . . . 0.0 113.172 -171.429 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . 0.454 ' N ' HD22 ' A' ' 511' ' ' LEU . 49.1 tpp -101.83 118.83 37.74 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 522' ' ' PHE . 24.2 tp -105.14 126.62 52.28 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.531 0.681 . . . . 0.0 110.183 -177.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 79.6 mt -123.97 135.04 53.38 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.184 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -89.61 123.44 33.68 Favored 'General case' 0 C--N 1.285 -2.212 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.335 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.3 t -98.72 110.19 22.83 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 31.7 m -68.33 -27.25 66.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.494 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.17 -44.13 96.29 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.422 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -103.79 1.09 31.2 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.821 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . 0.421 0.0 OUTLIER 49.15 34.92 6.44 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.11 2.164 . . . . 0.0 114.421 -176.352 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -137.62 167.83 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.802 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.095 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 70.0 m-85 -98.19 136.79 37.9 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.233 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -119.56 145.91 45.96 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -156.23 154.12 25.27 Favored Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 118.285 -1.912 . . . . 0.0 113.516 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.516 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 10.6 mp -115.37 135.02 54.56 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 171.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.53 HG12 HD23 ' A' ' 511' ' ' LEU . 16.5 mt -101.36 107.45 50.84 Favored Pre-proline 0 N--CA 1.439 -0.983 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.568 ' HG2' ' CD2' ' A' ' 533' ' ' PHE . 35.9 Cg_exo -72.19 138.46 30.62 Favored 'Trans proline' 0 C--O 1.292 3.179 0 C-N-CA 122.994 2.463 . . . . 0.0 111.944 170.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -77.07 -43.07 35.74 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.302 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.41 92.25 4.57 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.64 0.734 . . . . 0.0 110.156 -176.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . 0.253 0.0 OUTLIER -67.21 -31.08 71.21 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 114.959 -1.018 . . . . 0.0 113.569 -179.367 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.3 m -62.83 -47.55 82.9 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -176.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.98 -34.69 52.07 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.229 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.568 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 49.9 t80 -68.36 -48.08 65.73 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . 0.505 HG22 ' NE2' ' A' ' 499' ' ' HIS . 95.2 t -64.44 -39.12 84.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 O-C-N 123.181 0.3 . . . . 0.0 110.508 -178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -67.12 -40.38 86.8 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 109.762 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -64.09 -46.53 90.96 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.532 ' O ' HG13 ' A' ' 541' ' ' ILE . 43.7 mm -64.01 -37.38 79.65 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 C-N-CA 122.247 0.219 . . . . 0.0 110.799 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -57.87 -39.67 78.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 110.119 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . 0.528 ' HA ' HG22 ' A' ' 542' ' ' THR . 49.0 mt-30 -67.66 -34.09 76.23 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 91.1 t -67.41 -48.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.748 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 537' ' ' ILE . 62.2 mt -60.97 -44.88 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . 0.528 HG22 ' HA ' ' A' ' 539' ' ' GLN . 1.9 t -67.86 -33.55 74.97 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.822 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.25 -42.55 88.42 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? . . . . . 0 CA--C 1.544 0.742 0 C-N-CA 123.577 0.751 . . . . 0.0 110.664 178.964 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.425 -1.712 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.48 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.2 mp -108.68 136.29 48.51 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 64.1 tp -70.1 118.83 13.43 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.19 -51.24 2.86 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.499 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 78.4 t90 -155.19 149.21 25.72 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.459 -172.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 13.1 p -130.61 117.63 19.81 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 176.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.499 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -159.54 -172.53 26.83 Favored Glycine 0 N--CA 1.433 -1.562 0 C-N-CA 119.795 -1.193 . . . . 0.0 112.589 -175.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -112.03 136.69 47.43 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-O 121.099 0.476 . . . . 0.0 109.876 -176.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.526 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.4 mp -113.19 139.08 49.07 Favored 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.491 ' HG3' ' HB3' ' A' ' 426' ' ' SER . 30.2 tt0 -116.22 126.83 54.16 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -178.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . 0.456 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 19.3 p-90 . . . . . 0 C--N 1.302 -1.491 0 CA-C-O 121.46 0.647 . . . . 0.0 112.584 -175.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.416 -2.164 0 CA-C-O 121.056 0.455 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 407' ' ' GLU . 51.4 p -142.2 138.55 31.57 Favored 'General case' 0 N--CA 1.409 -2.506 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 81.1 mt -135.41 135.77 23.0 Favored Pre-proline 0 C--N 1.307 -1.242 0 O-C-N 122.852 0.095 . . . . 0.0 110.861 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.45 135.93 20.9 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.573 2.182 . . . . 0.0 112.043 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . 0.526 ' SG ' HD13 ' A' ' 406' ' ' LEU . 20.3 p -142.29 167.13 22.84 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.493 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -115.79 129.88 56.62 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 45.3 t -114.05 123.98 70.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.719 0 CA-C-O 122.143 0.973 . . . . 0.0 110.792 -175.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -113.47 160.42 18.48 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 114.035 -1.439 . . . . 0.0 107.39 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 471' ' ' VAL . 15.4 m -122.75 141.77 41.87 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 CA-C-O 120.694 0.283 . . . . 0.0 111.6 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 470' ' ' MET . 3.0 m120 -94.59 132.16 39.59 Favored 'General case' 1 C--O 1.314 4.448 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 168.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.48 ' CD2' HD11 ' A' ' 399' ' ' LEU . 73.4 m-70 -39.26 165.72 0.0 OUTLIER 'General case' 0 C--N 1.37 1.463 0 O-C-N 127.387 2.929 . . . . 0.0 116.197 -168.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.33 -2.39 31.1 Favored Glycine 0 CA--C 1.502 -0.766 0 N-CA-C 109.096 -1.601 . . . . 0.0 109.096 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.409 ' CB ' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -106.63 161.91 14.22 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.05 -1.075 . . . . 0.0 113.118 -174.439 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -160.88 94.49 1.03 Allowed 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . 0.512 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 2.3 pt? -141.92 151.22 42.41 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.252 178.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -102.47 135.49 44.0 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.432 HG21 ' HB2' ' A' ' 402' ' ' TRP . 14.0 p -94.6 23.15 5.54 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -171.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -75.55 -28.33 58.97 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.255 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -72.07 -15.52 62.01 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.208 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -88.24 126.84 59.32 Favored Pre-proline 0 C--N 1.311 -1.07 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.455 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . 0.435 ' HG2' ' HD2' ' A' ' 501' ' ' PRO . 23.5 Cg_exo -69.84 157.88 58.73 Favored 'Trans proline' 0 C--O 1.224 -0.223 0 C-N-CA 122.186 1.924 . . . . 0.0 110.05 173.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -77.35 -5.98 51.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.128 0.489 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -119.9 124.94 47.27 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 406' ' ' LEU . 53.2 mt -118.17 146.69 44.01 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 71.8 mt -101.93 117.79 47.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.887 -176.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.456 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 23.3 ptm -112.82 128.96 56.58 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 121.586 0.708 . . . . 0.0 110.067 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -114.76 130.75 56.89 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.99 124.63 29.31 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.498 0.666 . . . . 0.0 111.503 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.6 pt -133.82 161.42 63.84 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.395 1.078 . . . . 0.0 108.814 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -65.64 128.98 21.18 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 121.385 1.39 . . . . 0.0 111.406 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -63.86 -26.61 68.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.586 0.754 . . . . 0.0 110.388 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.27 -33.02 67.19 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.335 1.054 . . . . 0.0 112.7 -174.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 540' ' ' VAL . 90.8 mt -87.06 8.79 22.03 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 39.0 tp -69.73 -22.68 63.36 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.303 0.573 . . . . 0.0 110.483 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 5.1 m -65.62 -29.52 70.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.671 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 9.9 m -72.04 -20.39 61.69 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.757 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 83.1 mt -96.03 10.33 37.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.599 -175.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.22 -51.5 8.99 Favored Glycine 0 CA--C 1.553 2.462 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.1 -19.5 66.6 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.893 2.395 . . . . 0.0 113.94 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -80.16 -42.36 23.57 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -71.68 -13.66 61.8 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.583 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -53.86 -31.79 50.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.14 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -138.13 97.84 3.49 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.9 m -150.4 170.21 19.59 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.292 0.568 . . . . 0.0 111.553 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.512 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 97.3 mtt180 -112.52 142.51 45.0 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.669 ' HB2' ' HB2' ' A' ' 434' ' ' ASN . 61.5 mtp -98.78 151.96 20.22 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 116.944 -1.903 . . . . 0.0 111.242 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 433' ' ' VAL . 26.4 m -135.09 155.39 37.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.891 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -127.76 129.76 47.59 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 25.0 m-85 -112.88 117.98 33.63 Favored 'General case' 0 C--N 1.282 -2.326 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.847 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -121.31 123.73 42.88 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 57.8 m-85 . . . . . 0 C--N 1.296 -1.722 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.624 -179.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 80.7 mt . . . . . 0 N--CA 1.448 -0.55 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -70.5 -36.55 73.86 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.944 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 38.7 m -65.09 -38.0 89.34 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.13 -41.86 89.91 Favored 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.007 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -54.41 -41.26 69.11 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.037 0.535 . . . . 0.0 111.6 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.488 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -63.15 -46.51 93.05 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.708 178.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.0 tp -66.7 -41.59 87.77 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.73 0.412 . . . . 0.0 110.737 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -61.16 -38.89 88.09 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.237 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -66.39 -46.0 78.13 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 485' ' ' GLY . 67.6 mt -62.55 -51.15 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . 0.487 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 85.3 mtp -73.46 -36.19 65.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.117 0.484 . . . . 0.0 111.558 -176.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.34 71.03 Favored Glycine 0 C--O 1.219 -0.804 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.602 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.5 4.97 25.62 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.036 0.934 . . . . 0.0 110.611 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.57 29.52 6.96 Favored Glycine 0 C--N 1.316 -0.581 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.042 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -112.61 147.38 36.82 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 174.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -118.61 159.98 22.62 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.05 115.87 3.19 Favored Glycine 0 N--CA 1.421 -2.327 0 C-N-CA 120.189 -1.005 . . . . 0.0 110.721 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.1 t -88.32 128.3 35.49 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 75.6 t -100.99 120.57 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-O 121.664 0.745 . . . . 0.0 109.3 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -113.42 134.66 54.53 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -84.12 132.24 48.58 Favored Pre-proline 0 C--N 1.289 -2.061 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.035 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' A' ' 445' ' ' PRO . 31.4 Cg_exo . . . . . 0 N--CA 1.493 1.49 0 C-N-CA 123.595 2.863 . . . . 0.0 114.72 176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.0 t . . . . . 0 C--O 1.243 0.72 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 75.14 -178.67 0.16 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.395 1.478 . . . . 0.0 109.754 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.7 m -138.14 162.83 30.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.854 -0.739 . . . . 0.0 109.855 176.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.57 HD13 ' HB ' ' A' ' 526' ' ' ILE . 17.7 tp -135.01 150.04 50.26 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -170.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 40.2 tpp -108.93 140.78 41.95 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.529 HD11 ' HB3' ' A' ' 522' ' ' PHE . 52.7 tp -125.57 122.89 37.81 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.244 0.545 . . . . 0.0 109.952 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 73.3 mt -126.98 139.31 53.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.114 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -93.83 124.55 37.9 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.559 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 16.9 m -106.7 110.58 22.8 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 176.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 18.5 m -68.57 -35.68 77.71 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.834 -1.075 . . . . 0.0 113.218 -174.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -77.3 -29.41 53.69 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 121.449 0.643 . . . . 0.0 110.113 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -87.32 -10.62 51.78 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.89 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 58.24 27.41 15.13 Favored 'General case' 0 C--N 1.345 0.371 0 C-N-CA 124.876 1.27 . . . . 0.0 111.709 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.33 166.58 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.568 0 CA-C-O 121.232 0.539 . . . . 0.0 111.688 -176.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 42.5 m-85 -98.49 138.57 35.52 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 58.3 ttp -133.35 143.08 48.74 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . 0.429 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -151.89 158.94 28.05 Favored Glycine 0 N--CA 1.414 -2.77 0 C-N-CA 119.253 -1.451 . . . . 0.0 112.475 -178.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.479 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 10.3 mp -115.3 139.45 49.96 Favored 'General case' 0 C--N 1.291 -1.94 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.57 ' HB ' HD13 ' A' ' 511' ' ' LEU . 4.9 tt -107.05 108.32 61.81 Favored Pre-proline 0 C--O 1.254 1.324 0 CA-C-O 120.941 0.4 . . . . 0.0 111.65 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.516 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.2 Cg_exo -72.12 138.66 31.17 Favored 'Trans proline' 0 C--O 1.294 3.294 0 C-N-CA 123.433 2.755 . . . . 0.0 113.066 172.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -71.3 -45.32 63.34 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 113.114 -1.857 . . . . 0.0 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.02 104.69 13.41 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.364 0.602 . . . . 0.0 111.166 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -36.07 81.12 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.626 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 80.3 p -63.71 -47.66 80.22 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -72.1 -38.74 59.32 Favored Glycine 0 N--CA 1.434 -1.477 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.432 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.497 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 44.9 t80 -71.05 -47.36 58.94 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.245 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.55 -38.53 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.318 0.58 . . . . 0.0 109.61 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -59.59 -41.47 90.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.809 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -67.85 -41.81 87.58 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.176 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.497 ' O ' HG13 ' A' ' 541' ' ' ILE . 47.6 mm -61.55 -36.7 74.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 122.492 0.317 . . . . 0.0 110.433 177.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -56.39 -38.69 71.82 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.863 0.363 . . . . 0.0 110.525 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -67.3 -41.8 84.79 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 457' ' ' LEU . 54.4 t -63.28 -43.87 98.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.118 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 537' ' ' ILE . 71.9 mt -59.98 -44.58 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.464 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 83.4 m -62.84 -38.94 92.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.741 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -67.55 -38.21 83.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.087 0.47 . . . . 0.0 110.026 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.6 tp . . . . . 0 C--N 1.324 -0.524 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.988 178.061 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 63.6 mttp . . . . . 0 N--CA 1.427 -1.584 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.446 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.5 mp -90.33 122.49 33.27 Favored 'General case' 0 C--N 1.284 -2.256 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.096 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 60.0 tp -62.36 116.35 4.98 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 175.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.29 -52.92 2.26 Favored 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.54 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 51.4 t90 -146.34 133.66 20.65 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 118.85 -1.14 . . . . 0.0 112.71 -170.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 38.5 t -111.2 119.94 40.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.54 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.08 -173.46 26.53 Favored Glycine 0 N--CA 1.426 -1.974 0 C-N-CA 119.411 -1.376 . . . . 0.0 112.43 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.2 142.44 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . 0.427 HD11 ' CE1' ' A' ' 473' ' ' PHE . 88.9 mt -112.67 138.49 49.39 Favored 'General case' 0 C--N 1.293 -1.868 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . 0.525 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 26.3 mt-10 -115.67 125.73 53.23 Favored 'General case' 0 N--CA 1.402 -2.858 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.979 175.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 . . . . . 0 C--N 1.285 -2.227 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.374 -175.365 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 31.0 mmt180 . . . . . 0 CA--C 1.505 -0.777 0 CA-C-O 120.479 0.18 . . . . 0.0 111.155 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 2.9 p -110.84 139.94 45.72 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -173.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . 0.526 HD13 HD23 ' A' ' 483' ' ' LEU . 77.2 mt -137.12 125.09 14.5 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.985 175.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.23 146.62 32.07 Favored 'Trans proline' 0 C--O 1.248 0.979 0 C-N-CA 122.707 2.271 . . . . 0.0 111.605 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 21.7 p -147.49 167.46 24.4 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.817 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -116.48 129.89 56.46 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 41.4 t -124.87 123.85 66.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.923 0 CA-C-O 121.988 0.899 . . . . 0.0 112.18 -175.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -109.13 158.6 17.63 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 27.8 m -121.77 139.82 47.66 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.994 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.795 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 48.6 t30 -95.72 131.83 41.57 Favored 'General case' 1 C--O 1.308 4.158 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 174.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.523 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 29.1 m-70 -37.41 153.19 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 O-C-N 127.773 3.171 . . . . 0.0 116.448 -167.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.54 -2.42 30.77 Favored Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.929 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . 0.523 ' OE1' ' HA ' ' A' ' 435' ' ' HIS . 1.0 OUTLIER -82.36 161.08 22.66 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 124.281 1.032 . . . . 0.0 112.638 -173.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -146.02 96.05 2.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.618 167.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 441' ' ' THR . 0.0 OUTLIER -140.34 141.37 35.67 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.088 175.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -104.06 106.85 17.5 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 105.107 -2.183 . . . . 0.0 105.107 166.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.565 HG23 HD23 ' A' ' 439' ' ' LEU . 8.1 p -70.13 -12.68 61.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.021 0.915 . . . . 0.0 112.588 -175.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -68.49 -22.75 64.53 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.63 174.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -103.58 12.52 34.88 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 122.305 1.05 . . . . 0.0 108.982 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 445' ' ' PRO . 9.9 m0 -93.57 140.55 23.16 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 444' ' ' TRP . 16.9 Cg_exo -70.89 144.83 49.05 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 122.042 1.828 . . . . 0.0 109.045 171.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -81.35 -5.25 57.65 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.918 0.39 . . . . 0.0 111.183 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -128.25 120.19 26.66 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.994 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.33 147.18 41.82 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.9 mm -99.23 123.2 51.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.815 0.34 . . . . 0.0 110.207 -175.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.26 135.41 53.87 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.109 0.48 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . 0.581 ' HB3' ' SG ' ' A' ' 497' ' ' CYS . 8.1 tp-100 -117.83 131.13 56.6 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.94 125.07 33.8 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.9 pt -134.2 159.86 70.73 Favored Pre-proline 0 C--N 1.317 -0.839 0 C-N-CA 123.218 0.607 . . . . 0.0 110.16 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -64.11 129.31 23.98 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 121.861 1.707 . . . . 0.0 112.1 176.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.55 -29.52 70.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.676 0.79 . . . . 0.0 111.386 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -57.75 -41.2 81.41 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.132 0.491 . . . . 0.0 111.93 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.403 HD12 HG13 ' A' ' 540' ' ' VAL . 73.8 mt -76.16 -8.73 57.69 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.568 -173.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 51.1 tp -70.15 -16.79 63.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.582 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.5 t -60.5 -25.18 65.89 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-O 121.026 0.441 . . . . 0.0 111.316 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 5.3 m -71.31 -19.33 62.33 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.438 0.695 . . . . 0.0 110.652 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.0 4.27 52.78 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.999 0.428 . . . . 0.0 111.443 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.32 -54.23 3.28 Favored Glycine 0 CA--C 1.548 2.129 0 CA-C-N 114.319 -1.31 . . . . 0.0 115.583 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.5 -20.84 51.26 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 122.914 2.409 . . . . 0.0 114.723 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.72 -36.96 59.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.835 -0.54 . . . . 0.0 110.884 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -68.97 -13.21 62.31 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.865 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.61 -36.13 79.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.85 89.02 3.03 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 109.592 175.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 525' ' ' LEU . 49.3 m -144.14 160.17 41.38 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.342 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -111.23 141.93 44.1 Favored 'General case' 0 C--N 1.284 -2.269 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.795 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 72.4 mtp -98.39 153.01 18.88 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 118.036 -1.466 . . . . 0.0 112.159 -170.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 22.1 m -134.18 162.15 39.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.596 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -133.29 123.08 24.84 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 173.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 17.2 m-85 -107.72 134.39 50.76 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.898 0.749 . . . . 0.0 110.068 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -133.93 123.51 24.81 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 172.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 . . . . . 0 C--N 1.289 -2.03 0 C-N-CA 121.204 -0.198 . . . . 0.0 110.761 -178.19 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 96.3 mt . . . . . 0 N--CA 1.449 -0.477 0 N-CA-C 112.676 0.621 . . . . 0.0 112.676 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -70.64 -41.7 71.82 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 9.3 t -67.75 -43.07 80.74 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . 0.526 HD23 HD13 ' A' ' 427' ' ' LEU . 83.8 mt -64.69 -30.16 71.17 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.84 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 88.0 tttt -54.99 -47.27 74.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.115 0.566 . . . . 0.0 110.817 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -64.38 -42.04 97.85 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.957 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.8 tt -65.03 -45.05 87.06 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -60.31 -40.3 90.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.285 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . 0.562 ' HA ' ' CZ ' ' A' ' 488' ' ' ARG . 2.6 mmp_? -62.92 -50.28 71.46 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.714 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 76.3 mt -57.71 -45.47 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 122.703 0.401 . . . . 0.0 110.649 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 19.0 mmt -63.92 -43.87 94.59 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.312 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.93 -22.59 74.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.337 -0.392 . . . . 0.0 112.335 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -76.76 -7.02 54.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.822 0.449 . . . . 0.0 111.641 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.4 30.4 6.96 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 119.373 -1.394 . . . . 0.0 112.482 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.73 162.24 13.7 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -125.18 158.35 34.19 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -117.41 108.24 1.67 Allowed Glycine 0 N--CA 1.426 -1.988 0 C-N-CA 120.3 -0.952 . . . . 0.0 111.601 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 451' ' ' GLN . 10.6 p -83.87 118.55 24.04 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.4 121.28 55.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.17 136.09 50.74 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.219 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -97.64 133.46 23.54 Favored Pre-proline 0 C--N 1.291 -1.959 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo . . . . . 0 N--CA 1.454 -0.838 0 N-CA-C 107.909 -1.612 . . . . 0.0 107.909 169.117 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 48.0 t . . . . . 0 CA--C 1.52 -0.209 0 N-CA-C 107.416 -1.328 . . . . 0.0 107.416 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 527' ' ' PRO . 11.1 mmt180 -98.06 -166.76 1.42 Allowed 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.091 -168.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 22.6 m -121.53 163.07 19.93 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.151 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.944 -177.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.559 ' HB2' HG12 ' A' ' 526' ' ' ILE . 14.4 tp -130.91 145.81 52.13 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -170.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 32.4 tpp -113.42 120.71 41.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.308 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.439 HD11 ' HB3' ' A' ' 522' ' ' PHE . 45.9 tp -105.87 126.8 52.61 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.226 0.536 . . . . 0.0 110.076 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 80.7 mt -132.36 148.75 52.43 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.435 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.25 128.65 52.02 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-O 120.702 0.286 . . . . 0.0 110.773 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 18.8 m -107.86 110.66 22.49 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.5 p -68.18 -35.87 78.71 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 124.43 1.092 . . . . 0.0 113.218 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.86 -33.38 66.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -97.39 -3.65 39.86 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.42 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 520' ' ' LYS . 24.9 tptp 59.67 36.62 22.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.795 1.238 . . . . 0.0 111.298 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -140.66 165.59 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.981 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.044 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 39.7 m-85 -103.39 132.52 49.58 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.0 ptm -110.8 157.6 19.61 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . 0.406 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -164.23 143.59 8.69 Favored Glycine 0 N--CA 1.405 -3.418 0 C-N-CA 119.094 -1.527 . . . . 0.0 112.021 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . 0.492 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 11.0 mp -114.92 137.74 51.63 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 172.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.8 mt -107.11 106.97 59.75 Favored Pre-proline 0 N--CA 1.428 -1.551 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.559 ' O ' ' HB3' ' A' ' 509' ' ' ARG . 29.4 Cg_exo -70.32 134.01 25.82 Favored 'Trans proline' 0 C--O 1.292 3.212 0 C-N-CA 123.186 2.591 . . . . 0.0 112.189 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -76.78 -27.43 55.28 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 113.37 -1.741 . . . . 0.0 112.058 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.04 90.11 7.99 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -66.82 -33.69 76.17 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.926 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.4 p -58.27 -48.32 80.81 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -174.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.76 -34.36 43.69 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.801 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . 0.407 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 51.6 t80 -68.52 -47.7 66.27 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 538' ' ' ARG . 89.6 t -62.65 -40.69 89.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 O-C-N 123.352 0.407 . . . . 0.0 110.22 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -57.64 -45.93 84.82 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . 0.447 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -69.18 -44.95 63.7 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.73 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 41.8 mm -63.32 -34.07 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 122.558 0.343 . . . . 0.0 111.754 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 534' ' ' VAL . 56.9 mtp180 -56.17 -46.77 79.22 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.94 -39.94 95.31 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.742 0.651 . . . . 0.0 109.57 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 536' ' ' GLY . 97.7 t -60.86 -48.09 90.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.553 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 79.5 mt -61.81 -45.47 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.07 0.462 . . . . 0.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 54.3 m -62.06 -40.37 95.55 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.647 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -67.69 -36.77 81.29 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? . . . . . 0 CA--C 1.542 0.665 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.27 176.586 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.433 -1.282 0 N-CA-C 109.578 -0.527 . . . . 0.0 109.578 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 399' ' ' LEU . . . . . 0.438 ' CD2' ' HB3' ' A' ' 435' ' ' HIS . 2.4 mp -108.84 119.34 39.25 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 67.1 tp -69.02 121.46 16.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -120.67 -46.02 2.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -176.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 402' ' ' TRP . . . . . 0.506 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 41.7 t90 -150.05 149.23 30.03 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.385 -174.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 10.3 p -133.66 117.71 17.32 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 173.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 404' ' ' GLY . . . . . 0.506 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.75 -172.29 25.67 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.306 -173.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 405' ' ' VAL . . . . . 0.536 HG12 ' HB2' ' A' ' 426' ' ' SER . 58.2 t -114.98 142.65 27.02 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 CA-C-O 121.023 0.44 . . . . 0.0 109.924 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 89.1 mt -113.05 133.36 55.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -116.29 134.41 54.93 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -176.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 408' ' ' TRP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 450' ' ' MET . 14.4 p-90 . . . . . 0 C--O 1.252 1.214 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -173.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.432 -1.367 0 CA-C-O 120.434 0.159 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 426' ' ' SER . . . . . 0.536 ' HB2' HG12 ' A' ' 405' ' ' VAL . 60.4 p -131.65 159.27 38.81 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -170.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 427' ' ' LEU . . . . . 0.446 HD13 HD11 ' A' ' 483' ' ' LEU . 50.8 mt -127.09 135.32 27.22 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.651 0.78 . . . . 0.0 110.021 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -82.47 132.6 6.92 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.821 2.347 . . . . 0.0 112.208 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 23.7 p -143.71 163.85 32.12 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.377 0.608 . . . . 0.0 112.212 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -116.77 130.06 56.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 43.0 t -117.64 123.78 72.19 Favored 'Isoleucine or valine' 0 C--O 1.268 2.059 0 CA-C-O 122.071 0.938 . . . . 0.0 110.768 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -109.88 158.24 18.39 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.436 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 433' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 471' ' ' VAL . 33.4 m -121.67 141.52 41.77 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.37 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 434' ' ' ASN . . . . . 0.521 ' HB2' ' CB ' ' A' ' 470' ' ' MET . 11.7 m120 -94.51 130.28 40.98 Favored 'General case' 1 C--O 1.308 4.147 0 N-CA-C 103.3 -2.852 . . . . 0.0 103.3 163.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 435' ' ' HIS . . . . . 0.438 ' HB3' ' CD2' ' A' ' 399' ' ' LEU 0.309 31.6 p-80 -63.47 -175.91 0.14 Allowed 'General case' 0 N--CA 1.426 -1.641 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 -160.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.44 -11.25 33.28 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 105.337 -3.105 . . . . 0.0 105.337 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -128.91 149.02 50.96 Favored 'General case' 0 N--CA 1.383 -3.811 0 C-N-CA 127.306 2.242 . . . . 0.0 105.958 177.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -161.73 102.88 1.18 Allowed 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -137.82 151.9 48.57 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.647 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -94.6 123.09 37.83 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 170.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' THR . . . . . 0.496 HG21 ' HB2' ' A' ' 402' ' ' TRP . 11.7 p -83.45 38.12 0.6 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -170.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -75.64 -23.74 56.37 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.89 0.853 . . . . 0.0 109.079 175.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -88.48 -0.78 57.58 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.541 -177.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -99.71 131.5 24.58 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.826 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 18.8 Cg_exo -69.18 162.76 40.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.73 1.62 . . . . 0.0 108.965 172.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -80.45 -7.23 59.07 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.068 -0.395 . . . . 0.0 110.849 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 56.4 mtpt -126.97 126.95 44.06 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.996 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 64.2 mt -113.26 148.46 35.52 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.881 177.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.38 122.8 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 -173.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 408' ' ' TRP . 79.9 mtp -100.14 118.5 36.61 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.642 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -110.81 113.87 26.79 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.1 mt -76.49 127.25 32.47 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 31.3 pt -136.59 161.6 60.98 Favored Pre-proline 0 C--N 1.309 -1.177 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.42 128.85 15.02 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 CA-C-N 120.109 1.075 . . . . 0.0 111.569 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -62.97 -26.35 68.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.164 0.986 . . . . 0.0 110.698 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -57.48 -38.63 74.83 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.649 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 63.9 mt -87.06 -2.06 58.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.954 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.8 tt -72.78 -24.19 60.9 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.302 0.641 . . . . 0.0 111.284 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.5 m -57.03 -31.51 65.23 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.675 0.79 . . . . 0.0 112.045 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.8 m -71.86 -18.04 62.09 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 121.3 0.571 . . . . 0.0 111.951 -177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.18 0.85 52.68 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.851 -0.531 . . . . 0.0 111.539 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . 0.413 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -39.7 -52.32 3.12 Favored Glycine 0 CA--C 1.551 2.288 0 CA-C-N 114.4 -1.273 . . . . 0.0 115.355 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 6.8 Cg_endo -50.25 -33.17 35.45 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.534 2.823 . . . . 0.0 114.021 178.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.64 -38.42 65.02 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 110.18 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -69.04 -13.62 62.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.537 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.23 -11.61 59.61 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.568 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.17 92.05 2.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.277 1.037 . . . . 0.0 108.995 171.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 61.7 m -148.14 169.86 19.08 Favored 'General case' 0 N--CA 1.422 -1.868 0 CA-C-O 121.987 0.898 . . . . 0.0 111.922 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' ARG . . . . . 0.422 ' HG3' ' HB ' ' A' ' 526' ' ' ILE . 10.7 ptm180 -111.29 142.16 43.88 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 126.739 2.016 . . . . 0.0 107.384 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' MET . . . . . 0.521 ' CB ' ' HB2' ' A' ' 434' ' ' ASN . 2.7 mmm -97.62 148.84 22.89 Favored 'General case' 0 CA--C 1.483 -1.628 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.673 -173.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 433' ' ' VAL . 21.4 m -138.32 151.6 24.91 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -127.01 128.89 47.06 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' PHE . . . . . 0.436 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 22.1 m-85 -107.77 116.54 32.14 Favored 'General case' 0 C--O 1.271 2.226 0 CA-C-O 121.867 0.841 . . . . 0.0 110.419 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -123.57 122.57 38.52 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 105.898 -1.889 . . . . 0.0 105.898 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 . . . . . 0 C--N 1.292 -1.919 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -177.953 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 27.4 mt . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 115.185 1.55 . . . . 0.0 115.185 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.22 -51.53 20.65 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 118.944 0.793 . . . . 0.0 110.929 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 17.9 m -71.27 -47.55 56.28 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -173.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' LEU . . . . . 0.467 ' HB3' ' CE1' ' A' ' 487' ' ' TYR . 8.0 mp -73.87 -19.27 60.77 Favored 'General case' 0 C--O 1.193 -1.878 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.389 -177.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -62.52 -34.43 76.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.621 0.724 . . . . 0.0 109.158 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -69.77 -47.13 50.04 Favored Glycine 0 N--CA 1.438 -1.205 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.872 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -39.21 90.71 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.942 0.897 . . . . 0.0 111.729 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' TYR . . . . . 0.467 ' CE1' ' HB3' ' A' ' 483' ' ' LEU . 6.0 m-30 -61.19 -40.36 93.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.631 0.373 . . . . 0.0 110.369 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -67.13 -38.23 85.2 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.088 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 485' ' ' GLY . 64.0 mt -64.19 -49.51 80.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.08 0.466 . . . . 0.0 110.149 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 15.4 mmt -63.85 -35.5 80.83 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.29 -14.38 81.97 Favored Glycine 0 CA--C 1.527 0.828 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.078 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -84.17 -0.91 53.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.585 0.707 . . . . 0.0 109.676 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.89 29.99 6.99 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.861 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -107.02 161.6 14.59 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 120.945 0.403 . . . . 0.0 111.139 176.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -136.28 160.11 39.71 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -120.49 106.04 1.13 Allowed Glycine 0 N--CA 1.423 -2.221 0 C-N-CA 119.712 -1.233 . . . . 0.0 111.33 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' CYS . . . . . 0.426 ' SG ' HG21 ' A' ' 537' ' ' ILE . 49.9 t -82.88 123.38 29.33 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.95 120.85 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.131 0 CA-C-O 121.477 0.656 . . . . 0.0 110.165 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -107.74 143.48 36.2 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.562 -1.199 . . . . 0.0 108.377 176.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -98.68 129.77 29.34 Favored Pre-proline 0 C--N 1.285 -2.211 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.634 -175.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo . . . . . 0 CA--C 1.542 0.907 0 C-N-CA 122.402 2.068 . . . . 0.0 110.845 172.672 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 N--CA 1.441 -0.924 0 N-CA-C 110.436 -0.209 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 73.86 149.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.986 1.314 . . . . 0.0 109.222 -178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.5 m -122.38 160.15 24.84 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.041 0 C-N-CA 117.326 -1.75 . . . . 0.0 111.883 -174.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.549 ' HB2' HG12 ' A' ' 526' ' ' ILE . 13.5 tp -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -170.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 43.0 tpp -109.56 114.4 28.0 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.531 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -101.35 123.98 46.3 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.264 0.554 . . . . 0.0 110.037 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 72.7 mt -126.35 148.87 49.5 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.311 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -97.96 130.48 44.81 Favored 'General case' 0 C--N 1.273 -2.72 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.301 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 46.1 t -102.5 109.97 21.77 Favored 'General case' 0 N--CA 1.411 -2.379 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 33.7 p -69.64 -19.81 63.61 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.531 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -65.52 -44.32 87.32 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.037 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' LYS . . . . . 0.413 ' HB2' HG13 ' A' ' 521' ' ' ILE . 67.4 mttm -105.85 -9.86 16.97 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.426 -177.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 69.14 28.72 4.9 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.084 0.954 . . . . 0.0 110.737 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 519' ' ' LYS . 2.5 pp -134.62 168.82 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.835 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.022 -175.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' PHE . . . . . 0.531 ' HB3' HD11 ' A' ' 513' ' ' LEU . 19.2 m-85 -104.67 139.61 39.26 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.203 -172.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 22.9 mmt -124.17 160.31 28.14 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.89 153.6 21.13 Favored Glycine 0 N--CA 1.416 -2.634 0 C-N-CA 118.805 -1.664 . . . . 0.0 112.823 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -114.69 140.02 49.19 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 172.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.0 mt -108.21 107.6 60.35 Favored Pre-proline 0 N--CA 1.427 -1.585 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 33.5 Cg_exo -68.09 133.86 30.05 Favored 'Trans proline' 0 C--O 1.296 3.388 0 C-N-CA 122.441 2.094 . . . . 0.0 112.846 171.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.2 -35.2 68.87 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 113.092 -1.867 . . . . 0.0 106.848 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.11 65.73 0.81 Allowed 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.291 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -66.78 -38.04 85.77 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.59 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 12.2 m -63.81 -41.6 97.85 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 -177.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.42 -42.9 21.48 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.0 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -64.33 -47.47 79.26 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.197 0.199 . . . . 0.0 111.337 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.97 -39.04 82.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.02 -37.64 87.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.368 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -72.41 -47.3 29.2 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.385 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' ILE . . . . . 0.426 HG21 ' SG ' ' A' ' 497' ' ' CYS . 38.9 mm -62.97 -33.92 63.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 122.963 0.505 . . . . 0.0 111.837 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -56.14 -42.08 76.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 122.922 0.489 . . . . 0.0 110.034 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -66.2 -41.56 90.02 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.811 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 71.7 t -60.89 -44.87 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.043 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 90.3 mt -62.4 -45.72 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.84 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 19.0 m -67.48 -36.54 81.32 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.412 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -66.94 -37.03 83.56 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.4 tp . . . . . 0 C--O 1.224 -0.279 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.795 174.928 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 26.1 ptm . . . . . 0 N--CA 1.469 0.522 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 47.4 t 68.74 -50.87 0.58 Allowed 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.515 1.526 . . . . 0.0 113.33 -178.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 89.3 t -67.36 103.74 0.64 Allowed 'Isoleucine or valine' 0 N--CA 1.44 -0.971 0 C-N-CA 123.32 0.648 . . . . 0.0 110.458 -178.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 9.7 t -141.62 -15.23 0.83 Allowed 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.697 -179.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 20.4 m120 -76.25 -51.03 12.87 Favored 'General case' 0 CA--C 1.502 -0.882 0 N-CA-C 109.379 -0.6 . . . . 0.0 109.379 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . 0.49 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -145.23 135.55 24.07 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 115.049 -0.978 . . . . 0.0 109.825 178.478 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.419 ' N ' HD12 ' A' ' 399' ' ' LEU . 2.9 mp -102.03 134.52 45.12 Favored 'General case' 0 C--N 1.298 -1.648 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 -174.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 4.2 tt -75.77 124.72 27.76 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 179.1 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.03 -41.24 2.77 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 113.32 0.859 . . . . 0.0 113.32 -173.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.456 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 54.9 t90 -148.8 149.71 31.82 Favored 'General case' 0 C--N 1.309 -1.181 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 -173.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 48.6 m -138.98 117.67 12.24 Favored 'General case' 0 C--N 1.275 -2.643 0 N-CA-C 107.432 -1.321 . . . . 0.0 107.432 174.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.456 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -160.58 -172.46 27.87 Favored Glycine 0 N--CA 1.432 -1.594 0 N-CA-C 111.3 -0.72 . . . . 0.0 111.3 -174.488 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.478 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.8 t -108.98 142.11 22.44 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -175.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.444 ' HG ' ' SG ' ' A' ' 429' ' ' CYS . 86.0 mt -113.12 141.46 46.88 Favored 'General case' 0 C--N 1.292 -1.915 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 178.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.503 ' OE2' ' HG2' ' A' ' 447' ' ' LYS . 35.8 mt-10 -116.04 125.18 52.1 Favored 'General case' 0 N--CA 1.405 -2.688 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 174.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . 0.44 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 64.9 p-90 -117.4 139.49 50.81 Favored 'General case' 0 N--CA 1.425 -1.692 0 CA-C-N 115.227 -0.897 . . . . 0.0 112.452 -173.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -110.59 136.62 49.41 Favored 'General case' 0 N--CA 1.413 -2.32 0 CA-C-N 114.652 -1.158 . . . . 0.0 108.89 176.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -78.97 -30.71 44.61 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.588 177.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . 0.469 ' HB3' ' HG2' ' A' ' 422' ' ' LYS 0.304 17.0 ttpt -150.4 109.63 3.18 Favored Pre-proline 0 C--N 1.295 -1.768 0 N-CA-C 104.586 -2.375 . . . . 0.0 104.586 -165.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 42.9 Cg_endo -94.29 -31.42 0.06 OUTLIER 'Trans proline' 0 CA--C 1.539 0.734 0 N-CA-C 118.754 2.559 . . . . 0.0 118.754 -165.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -55.94 114.06 6.84 Favored Pre-proline 0 C--O 1.243 0.741 0 N-CA-C 115.303 1.594 . . . . 0.0 115.303 -167.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -81.37 103.79 1.44 Allowed 'Trans proline' 0 N--CA 1.447 -1.246 0 C-N-CA 122.864 2.376 . . . . 0.0 107.122 170.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . 0.426 ' HB3' ' HB3' ' A' ' 418' ' ' ASP . . . -92.56 1.68 57.12 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 114.088 1.144 . . . . 0.0 114.088 -169.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 33.1 m 71.16 -49.58 0.68 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.418 1.087 . . . . 0.0 111.678 -178.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 26.8 m -70.91 -16.65 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.348 0 N-CA-C 107.822 -1.177 . . . . 0.0 107.822 171.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . 0.445 ' OD2' ' HA ' ' A' ' 421' ' ' THR . 28.8 t70 -110.13 89.92 3.16 Favored 'General case' 0 N--CA 1.426 -1.657 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 172.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -78.85 -38.24 38.4 Favored 'General case' 0 C--N 1.318 -0.768 0 CA-C-N 115.344 -0.843 . . . . 0.0 109.987 -177.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -89.8 84.13 6.24 Favored 'General case' 0 CA--C 1.491 -1.304 0 N-CA-C 107.431 -1.322 . . . . 0.0 107.431 176.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . 0.445 ' HA ' ' OD2' ' A' ' 418' ' ' ASP . 64.7 m -73.27 82.9 1.37 Allowed 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 114.312 1.227 . . . . 0.0 114.312 -174.03 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . 0.505 ' HD2' ' N ' ' A' ' 422' ' ' LYS . 10.1 mptt 57.2 -175.88 0.06 Allowed 'General case' 0 C--O 1.239 0.514 0 CA-C-N 113.363 -1.744 . . . . 0.0 113.744 172.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 91.4 mt -103.32 133.38 48.48 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.97 179.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 17.0 m -106.46 139.56 40.75 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 107.205 -1.405 . . . . 0.0 107.205 178.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . 0.412 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 38.1 mmt180 -120.49 146.37 46.33 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.003 179.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 27.7 p -108.89 144.84 36.28 Favored 'General case' 0 C--N 1.3 -1.549 0 O-C-N 123.635 0.584 . . . . 0.0 110.987 -178.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 20.9 tp -146.97 126.89 6.7 Favored Pre-proline 0 C--N 1.305 -1.363 0 N-CA-C 108.234 -1.025 . . . . 0.0 108.234 178.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -75.97 142.05 24.59 Favored 'Trans proline' 0 C--O 1.243 0.766 0 C-N-CA 122.396 2.064 . . . . 0.0 112.17 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . 0.444 ' SG ' ' HG ' ' A' ' 406' ' ' LEU . 26.0 p -144.29 163.49 33.56 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-O 121.376 0.608 . . . . 0.0 111.78 -177.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 34.5 mt-30 -117.25 129.18 55.75 Favored 'General case' 0 N--CA 1.423 -1.792 0 N-CA-C 104.404 -2.443 . . . . 0.0 104.404 174.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 48.0 t -117.17 125.29 73.86 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.973 0 CA-C-O 121.794 0.807 . . . . 0.0 110.384 -175.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 62.0 m-85 -108.04 160.98 15.37 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 107.292 -1.373 . . . . 0.0 107.292 178.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 30.5 m -121.25 141.29 42.37 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.903 0 N-CA-C 109.476 -0.565 . . . . 0.0 109.476 175.148 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.709 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 53.8 t30 -94.1 131.31 39.75 Favored 'General case' 1 C--O 1.359 6.855 0 N-CA-C 107.82 -1.178 . . . . 0.0 107.82 173.952 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -38.43 148.1 0.05 OUTLIER 'General case' 0 C--N 1.363 1.161 3 O-C-N 130.865 5.103 . . . . 0.0 118.987 -161.856 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.51 -18.44 35.34 Favored Glycine 0 CA--C 1.494 -1.273 0 CA-C-N 112.528 -2.124 . . . . 0.0 110.858 174.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.606 ' OE2' ' HA ' ' A' ' 469' ' ' ARG . 5.6 mm-40 -98.07 118.0 33.69 Favored 'General case' 0 C--N 1.286 -2.166 0 CA-C-N 114.329 -0.936 . . . . 0.0 110.806 -170.262 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 7.0 t30 -108.73 108.45 19.28 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 177.349 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -138.23 156.02 48.08 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -102.39 121.38 42.21 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-O 121.316 0.579 . . . . 0.0 111.034 178.59 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.402 HG21 ' HB2' ' A' ' 402' ' ' TRP . 4.3 p -88.71 -13.59 39.29 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 113.791 1.034 . . . . 0.0 113.791 -174.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -65.96 -19.01 65.72 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-O 121.567 0.699 . . . . 0.0 109.626 174.135 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 96.2 mt-30 -82.1 -10.87 59.05 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.448 179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -84.0 141.76 40.99 Favored Pre-proline 0 C--O 1.245 0.864 0 N-CA-C 109.636 -0.505 . . . . 0.0 109.636 178.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.4 Cg_exo -67.31 163.18 35.48 Favored 'Trans proline' 0 CA--C 1.533 0.448 0 C-N-CA 122.567 2.178 . . . . 0.0 109.799 171.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -81.84 -9.93 59.47 Favored 'General case' 0 C--N 1.316 -0.864 0 N-CA-C 112.651 0.612 . . . . 0.0 112.651 -177.296 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.503 ' HG2' ' OE2' ' A' ' 407' ' ' GLU . 1.8 mptm? -124.47 135.99 53.67 Favored 'General case' 0 CA--C 1.497 -1.089 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.915 172.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . 0.43 HD22 ' CD1' ' A' ' 500' ' ' PHE . 56.3 mt -118.5 146.69 44.33 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 107.615 -1.254 . . . . 0.0 107.615 175.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 59.1 mt -98.82 116.93 43.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.44 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 22.5 ptm -122.87 134.32 54.39 Favored 'General case' 0 C--N 1.3 -1.58 0 CA-C-O 121.429 0.633 . . . . 0.0 112.186 -179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 50.5 tp60 -116.71 133.82 55.55 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 115.101 -0.954 . . . . 0.0 109.52 177.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -81.58 110.37 16.89 Favored 'General case' 0 C--N 1.306 -1.29 0 CA-C-O 121.296 0.569 . . . . 0.0 110.013 177.307 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 2.4 pp -118.4 152.95 51.59 Favored Pre-proline 0 C--N 1.301 -1.519 0 CA-C-N 115.263 -0.881 . . . . 0.0 109.713 178.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -65.96 128.69 20.24 Favored 'Trans proline' 0 CA--C 1.542 0.92 0 C-N-CA 121.032 1.155 . . . . 0.0 113.159 -177.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.27 -25.88 68.52 Favored 'General case' 0 C--N 1.324 -0.528 0 C-N-CA 125.137 1.375 . . . . 0.0 110.595 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 96.1 mt-30 -57.28 -41.16 79.21 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.461 179.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 8.3 mp -85.88 -8.89 57.76 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.984 0.421 . . . . 0.0 111.219 -177.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 54.8 tp -77.49 -20.0 55.01 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 115.818 -0.628 . . . . 0.0 110.201 -178.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 11.4 m -57.52 -28.72 63.74 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.015 0.926 . . . . 0.0 110.489 179.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -67.55 -22.42 65.4 Favored 'General case' 0 N--CA 1.434 -1.232 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.094 -177.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -98.59 9.64 42.8 Favored 'General case' 0 N--CA 1.464 0.273 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.653 -178.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -42.7 -55.89 4.49 Favored Glycine 0 CA--C 1.543 1.835 0 N-CA-C 116.31 1.284 . . . . 0.0 116.31 -177.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_endo -65.75 -19.79 59.22 Favored 'Trans proline' 0 C--N 1.362 1.289 0 CA-C-N 120.122 1.961 . . . . 0.0 113.17 -178.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.0 tp -76.22 -22.37 55.31 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 121.358 0.599 . . . . 0.0 109.997 -177.198 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -72.0 -13.54 61.64 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.957 177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -72.61 -9.87 59.12 Favored 'General case' 0 C--O 1.232 0.135 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.53 81.29 1.88 Allowed 'General case' 0 C--N 1.312 -1.057 0 CA-C-O 122.155 0.978 . . . . 0.0 110.164 173.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . 0.425 ' CB ' ' HB3' ' A' ' 525' ' ' LEU . 51.8 m -155.35 169.42 24.26 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.239 -175.345 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.606 ' HA ' ' OE2' ' A' ' 437' ' ' GLU . 0.1 OUTLIER -109.79 141.72 42.04 Favored 'General case' 0 C--N 1.313 -0.98 0 N-CA-C 105.825 -1.917 . . . . 0.0 105.825 -176.941 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.709 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 41.1 mtp -97.7 149.04 22.72 Favored 'General case' 0 N--CA 1.421 -1.912 0 C-N-CA 113.593 -3.243 . . . . 0.0 111.347 -172.972 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.598 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 11.6 m -135.17 160.58 40.64 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.048 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.371 178.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -139.77 133.62 30.69 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 65.2 m-85 -107.95 125.3 51.34 Favored 'General case' 0 C--N 1.293 -1.885 0 CA-C-O 121.628 0.728 . . . . 0.0 110.748 -178.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -121.32 123.2 41.59 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 173.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . 0.416 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 78.1 m-85 -90.03 143.73 26.52 Favored 'General case' 0 C--N 1.287 -2.139 0 C-N-CA 119.535 -0.866 . . . . 0.0 113.075 -174.579 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 22.2 m -80.83 99.35 8.25 Favored 'General case' 0 N--CA 1.409 -2.5 0 N-CA-C 105.917 -1.883 . . . . 0.0 105.917 175.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -66.84 78.55 0.12 Allowed 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -174.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.471 ' HG3' ' OD2' ' A' ' 479' ' ' ASP . 0.3 OUTLIER -80.89 -49.32 11.17 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.862 -1.517 . . . . 0.0 107.625 172.395 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . 0.471 ' OD2' ' HG3' ' A' ' 478' ' ' LYS . 0.9 OUTLIER -124.82 95.7 4.61 Favored 'General case' 0 C--N 1.297 -1.696 0 CA-C-N 115.132 -0.94 . . . . 0.0 111.126 -177.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 85.0 mt -62.27 -27.02 68.72 Favored 'General case' 0 C--O 1.211 -0.96 0 CA-C-N 115.744 -0.662 . . . . 0.0 112.077 178.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -65.6 -40.64 92.9 Favored 'General case' 0 C--N 1.326 -0.439 0 C-N-CA 121.072 -0.251 . . . . 0.0 110.622 176.321 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.8 m -66.54 -41.42 88.74 Favored 'General case' 0 N--CA 1.443 -0.819 0 N-CA-C 109.751 -0.463 . . . . 0.0 109.751 176.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -62.36 -48.18 80.92 Favored 'General case' 0 C--O 1.201 -1.495 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.777 176.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 37.5 ttpt -55.35 -47.03 76.34 Favored 'General case' 0 C--N 1.315 -0.902 0 C-N-CA 123.517 0.727 . . . . 0.0 110.868 -179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -63.24 -43.23 98.84 Favored Glycine 0 C--O 1.242 0.595 0 N-CA-C 111.643 -0.583 . . . . 0.0 111.643 178.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.473 HD21 ' SD ' ' A' ' 490' ' ' MET . 9.5 tt -66.28 -38.58 88.11 Favored 'General case' 0 N--CA 1.435 -1.181 0 C-N-CA 123.19 0.596 . . . . 0.0 110.91 179.101 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.2 m-30 -56.55 -41.39 76.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.172 0.589 . . . . 0.0 110.714 176.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 484' ' ' LYS . 24.8 mmt180 -60.97 -47.26 87.28 Favored 'General case' 0 C--O 1.223 -0.304 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 75.9 mt -68.44 -52.8 33.16 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.981 -176.543 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . 0.473 ' SD ' HD21 ' A' ' 486' ' ' LEU . 87.3 mtp -76.18 -23.1 54.7 Favored 'General case' 0 C--N 1.316 -0.885 0 C-N-CA 120.046 -0.662 . . . . 0.0 112.184 -175.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -81.41 -12.1 82.41 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 121.085 -0.578 . . . . 0.0 111.737 177.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -92.75 3.8 54.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 121.67 0.748 . . . . 0.0 110.008 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.93 30.15 6.54 Favored Glycine 0 N--CA 1.435 -1.4 0 C-N-CA 119.63 -1.271 . . . . 0.0 113.159 -178.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -104.71 141.0 37.24 Favored 'General case' 0 C--N 1.299 -1.61 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 170.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . 0.42 ' HB1' ' SD ' ' A' ' 512' ' ' MET . . . -118.54 147.91 43.19 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 108.509 -0.922 . . . . 0.0 108.509 -178.633 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -104.12 104.88 2.51 Favored Glycine 0 N--CA 1.421 -2.352 0 N-CA-C 110.77 -0.932 . . . . 0.0 110.77 -178.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . 0.455 ' SG ' HG13 ' A' ' 537' ' ' ILE . 42.1 t -82.88 119.83 24.89 Favored 'General case' 0 C--N 1.292 -1.922 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 178.335 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . 0.42 ' HB ' ' HB3' ' A' ' 511' ' ' LEU . 61.5 t -101.25 121.17 51.79 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.547 0 CA-C-N 115.282 -0.872 . . . . 0.0 109.645 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.8 m80 -109.01 137.94 46.13 Favored 'General case' 0 C--N 1.286 -2.164 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 175.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . 0.461 ' HD2' ' O ' ' A' ' 509' ' ' ARG . 95.5 m-85 -92.49 133.82 29.05 Favored Pre-proline 0 C--N 1.298 -1.658 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -56.62 160.18 12.25 Favored 'Trans proline' 0 C--O 1.25 1.087 0 C-N-CA 122.156 1.904 . . . . 0.0 110.604 172.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 53.3 t-80 -76.14 127.83 33.73 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-O 121.46 0.648 . . . . 0.0 110.227 -173.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 7.0 t -158.49 -38.58 0.06 Allowed 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 107.549 -1.278 . . . . 0.0 107.549 179.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -83.78 153.68 64.34 Favored Pre-proline 0 N--CA 1.441 -0.919 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 172.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 6.9 Cg_endo -47.83 -32.81 18.03 Favored 'Trans proline' 0 N--CA 1.49 1.309 0 C-N-CA 124.364 3.376 . . . . 0.0 116.39 -173.646 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 27.6 m -104.29 -75.24 0.62 Allowed 'General case' 0 C--N 1.314 -0.978 0 C-N-CA 120.027 -0.669 . . . . 0.0 110.867 -178.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -168.77 26.41 0.02 OUTLIER 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 -178.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.409 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 31.6 t 67.35 -97.66 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 114.54 -1.209 . . . . 0.0 110.377 -177.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.461 ' O ' ' HD2' ' A' ' 500' ' ' PHE . 96.8 mtt180 -169.76 -176.95 2.52 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.193 -3.262 . . . . 0.0 102.193 -174.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.585 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.8 m -134.93 155.97 39.04 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.749 0 CA-C-N 120.832 1.651 . . . . 0.0 111.235 177.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.618 HD13 ' HB ' ' A' ' 526' ' ' ILE . 40.6 tp -125.52 148.84 48.74 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-O 120.899 0.38 . . . . 0.0 111.609 -172.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . 0.42 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 39.0 tpp -113.78 138.76 49.81 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 109.903 -0.406 . . . . 0.0 109.903 175.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.552 HD21 ' HB3' ' A' ' 522' ' ' PHE . 0.9 OUTLIER -117.5 124.84 49.73 Favored 'General case' 0 C--N 1.313 -1.001 0 N-CA-C 107.535 -1.283 . . . . 0.0 107.535 179.072 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 87.8 mt -130.41 139.81 50.59 Favored 'General case' 0 C--N 1.293 -1.878 0 C-N-CA 123.605 0.762 . . . . 0.0 109.588 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 25.6 t80 -94.27 122.94 37.33 Favored 'General case' 0 C--N 1.296 -1.719 0 C-N-CA 120.504 -0.478 . . . . 0.0 109.926 178.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.9 p -105.83 110.62 22.98 Favored 'General case' 0 N--CA 1.418 -2.025 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 12.4 m -68.45 -32.11 71.89 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 114.594 -1.184 . . . . 0.0 110.391 -179.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 55.8 tptt -63.24 -41.52 99.09 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.845 -178.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -94.09 -5.91 46.25 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 179.639 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.9 tptt 62.55 21.36 12.6 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.402 1.481 . . . . 0.0 110.512 -179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -138.06 167.77 21.42 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.394 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.868 -173.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 61.3 m-85 -96.46 139.41 32.6 Favored 'General case' 0 N--CA 1.405 -2.693 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 -177.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.2 ptt? -128.39 165.9 19.72 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 108.391 -0.966 . . . . 0.0 108.391 -177.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . 0.42 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -178.39 153.7 13.32 Favored Glycine 0 N--CA 1.426 -2.01 0 C-N-CA 119.353 -1.403 . . . . 0.0 112.545 175.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.488 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 8.5 mp -115.19 140.04 49.42 Favored 'General case' 0 C--N 1.291 -1.958 0 C-N-CA 122.344 0.258 . . . . 0.0 110.429 174.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.618 ' HB ' HD13 ' A' ' 511' ' ' LEU . 3.0 tt -109.21 108.11 60.12 Favored Pre-proline 0 C--O 1.25 1.083 0 CA-C-O 120.899 0.381 . . . . 0.0 111.903 177.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.52 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 31.8 Cg_exo -69.86 140.35 42.1 Favored 'Trans proline' 0 C--O 1.283 2.766 0 C-N-CA 123.637 2.891 . . . . 0.0 112.764 171.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -70.64 -44.78 66.44 Favored 'General case' 0 N--CA 1.447 -0.586 0 CA-C-N 113.555 -1.657 . . . . 0.0 110.316 -178.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -85.16 101.88 12.83 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.575 -175.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.37 -31.98 72.59 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 115.076 -0.966 . . . . 0.0 111.956 178.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 18.5 m -59.3 -48.3 82.15 Favored 'General case' 0 C--N 1.325 -0.493 0 N-CA-C 112.394 0.516 . . . . 0.0 112.394 -174.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.8 -40.36 37.01 Favored Glycine 0 N--CA 1.437 -1.238 0 C-N-CA 120.743 -0.741 . . . . 0.0 112.179 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.507 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 34.3 t80 -70.59 -46.82 62.7 Favored 'General case' 0 C--N 1.316 -0.855 0 C-N-CA 120.814 -0.354 . . . . 0.0 110.647 -176.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 79.6 t -61.97 -38.89 81.82 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.906 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 178.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -57.54 -46.07 84.31 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 122.461 0.304 . . . . 0.0 110.352 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . 0.408 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -64.6 -42.05 97.54 Favored Glycine 0 N--CA 1.447 -0.591 0 C-N-CA 121.055 -0.593 . . . . 0.0 111.644 177.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.463 ' O ' HG13 ' A' ' 541' ' ' ILE . 48.2 mm -66.88 -35.82 75.65 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 C-N-CA 122.12 0.168 . . . . 0.0 110.945 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -56.1 -41.35 75.08 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.956 0.503 . . . . 0.0 110.144 175.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -63.0 -45.82 90.6 Favored 'General case' 0 CA--C 1.515 -0.372 0 CA-C-N 115.626 -0.715 . . . . 0.0 109.655 177.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.408 HG23 ' O ' ' A' ' 536' ' ' GLY . 55.7 t -62.4 -45.9 97.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.34 179.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 537' ' ' ILE . 66.7 mt -65.44 -45.43 92.94 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.35 0 C-N-CA 122.343 0.257 . . . . 0.0 111.42 -179.2 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.6 t -67.22 -35.73 80.2 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 120.272 -0.571 . . . . 0.0 109.949 -178.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 6.8 t30 -67.73 -42.16 82.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.195 0.521 . . . . 0.0 109.787 175.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 46.0 tp -64.28 -38.92 92.76 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.67 -178.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 50.4 mm-40 -70.67 -38.11 73.73 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 176.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 58.8 t60 -65.76 -39.51 91.13 Favored 'General case' 0 C--N 1.311 -1.107 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 178.194 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -71.93 -58.79 3.15 Favored 'General case' 0 C--N 1.31 -1.135 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 178.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 51.8 t-80 51.83 86.81 0.03 OUTLIER 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 126.671 1.988 . . . . 0.0 112.742 -179.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 38.7 t60 -115.98 32.01 6.37 Favored 'General case' 0 C--N 1.307 -1.245 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 179.252 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 51.0 m-70 -101.53 156.12 17.67 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 114.405 -1.271 . . . . 0.0 108.033 -178.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 71.7 m80 . . . . . 0 C--N 1.29 -1.996 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 178.887 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 24.6 mmt . . . . . 0 CA--C 1.503 -0.846 0 N-CA-C 107.854 -1.165 . . . . 0.0 107.854 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 36.9 m -90.18 14.44 12.54 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-O 121.233 0.539 . . . . 0.0 111.728 -177.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 19.6 m -91.75 81.83 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.992 0 CA-C-O 122.156 0.979 . . . . 0.0 109.665 177.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 16.2 m -102.54 -7.69 21.65 Favored 'General case' 0 C--N 1.305 -1.367 0 CA-C-N 114.965 -1.016 . . . . 0.0 111.997 -174.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -130.58 -53.89 1.08 Allowed 'General case' 0 CA--C 1.496 -1.119 0 CA-C-O 121.217 0.532 . . . . 0.0 109.576 -179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . 0.504 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -128.35 132.72 48.57 Favored 'General case' 0 N--CA 1.432 -1.346 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.028 178.112 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.5 mp -102.94 118.48 36.92 Favored 'General case' 0 C--N 1.302 -1.473 0 CA-C-N 115.75 -0.659 . . . . 0.0 109.281 -175.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -64.53 126.36 27.62 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 107.799 -1.185 . . . . 0.0 107.799 176.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -132.55 -46.0 0.89 Allowed 'General case' 0 N--CA 1.428 -1.564 0 N-CA-C 112.696 0.628 . . . . 0.0 112.696 -176.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.453 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 61.4 t90 -147.81 143.42 27.47 Favored 'General case' 0 N--CA 1.442 -0.837 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.376 -176.096 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 43.8 t -127.44 118.05 23.31 Favored 'General case' 0 C--N 1.289 -2.063 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 177.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.453 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -163.07 -172.51 30.65 Favored Glycine 0 N--CA 1.43 -1.755 0 C-N-CA 119.927 -1.13 . . . . 0.0 112.968 -175.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.53 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 53.3 t -113.28 141.4 29.18 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 C-N-CA 123.304 0.642 . . . . 0.0 109.354 -176.059 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.557 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.9 mp -114.08 140.54 48.39 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.081 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.562 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 69.0 mt-10 -115.61 126.05 53.7 Favored 'General case' 0 N--CA 1.415 -2.203 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.606 178.485 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 30.0 p-90 -122.74 153.66 39.17 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.483 -178.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -100.94 138.75 37.58 Favored 'General case' 0 C--N 1.287 -2.142 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.114 -177.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -68.79 -7.53 34.96 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.318 1.047 . . . . 0.0 110.885 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 56.2 tptt 64.43 86.67 0.13 Allowed Pre-proline 0 N--CA 1.453 -0.292 0 N-CA-C 107.128 -1.434 . . . . 0.0 107.128 -169.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo -43.69 108.23 0.11 Allowed 'Trans proline' 0 C--O 1.245 0.841 0 C-N-CA 124.627 3.551 . . . . 0.0 115.86 -170.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -112.24 93.64 23.0 Favored Pre-proline 0 C--N 1.298 -1.644 0 N-CA-C 105.786 -1.931 . . . . 0.0 105.786 171.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -62.62 112.28 1.57 Allowed 'Trans proline' 0 N--CA 1.455 -0.742 0 C-N-CA 121.95 1.767 . . . . 0.0 111.194 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -75.86 -3.05 33.06 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.902 -178.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 25.5 m 74.31 16.44 3.38 Favored 'General case' 0 CA--C 1.529 0.143 0 C-N-CA 124.906 1.282 . . . . 0.0 111.815 176.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 52.3 t -83.33 -35.7 12.05 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.626 0 N-CA-C 105.896 -1.89 . . . . 0.0 105.896 173.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -120.22 151.78 38.65 Favored 'General case' 0 C--N 1.308 -1.202 0 N-CA-C 104.794 -2.298 . . . . 0.0 104.794 174.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -71.39 -37.69 71.55 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 118.278 0.49 . . . . 0.0 112.112 -176.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 31.4 p30 -150.63 123.89 8.89 Favored 'General case' 0 C--N 1.314 -0.966 0 CA-C-O 121.606 0.717 . . . . 0.0 110.765 -179.806 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 4.9 t -138.41 107.52 6.05 Favored 'General case' 0 C--N 1.297 -1.707 0 CA-C-O 121.418 0.628 . . . . 0.0 111.044 -173.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -104.15 82.77 2.0 Allowed 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 106.572 -1.64 . . . . 0.0 106.572 176.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 53.4 tp -78.84 118.53 20.97 Favored 'General case' 0 N--CA 1.435 -1.198 0 CA-C-N 115.419 -0.809 . . . . 0.0 111.269 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 3.4 m -106.61 139.85 40.4 Favored 'General case' 0 N--CA 1.419 -1.981 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 178.339 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . 0.478 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 15.4 mmm180 -114.22 145.73 41.32 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 177.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.562 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 5.4 p -122.42 133.39 54.62 Favored 'General case' 0 N--CA 1.427 -1.596 0 O-C-N 123.259 0.349 . . . . 0.0 110.825 -176.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 95.0 mt -133.54 126.22 19.0 Favored Pre-proline 0 C--N 1.306 -1.302 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.191 -179.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -77.62 135.2 14.35 Favored 'Trans proline' 0 C--O 1.249 1.053 0 C-N-CA 122.263 1.975 . . . . 0.0 110.941 175.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . 0.577 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 20.8 p -143.21 167.02 23.1 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.336 -178.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -117.13 129.64 56.1 Favored 'General case' 0 N--CA 1.413 -2.29 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 175.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 47.7 t -112.16 122.61 66.76 Favored 'Isoleucine or valine' 0 N--CA 1.41 -2.452 0 CA-C-O 122.431 1.11 . . . . 0.0 109.958 -175.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 93.3 m-85 -108.72 160.22 16.13 Favored 'General case' 0 N--CA 1.397 -3.078 0 N-CA-C 104.726 -2.324 . . . . 0.0 104.726 175.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 25.8 m -120.87 140.75 44.04 Favored 'Isoleucine or valine' 0 C--N 1.266 -3.026 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.269 179.598 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.526 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 25.7 t-20 -95.72 131.03 42.43 Favored 'General case' 1 C--O 1.326 5.094 0 CA-C-N 115.129 -0.942 . . . . 0.0 109.712 179.011 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 28.0 m-70 -27.56 131.51 0.04 OUTLIER 'General case' 0 C--O 1.244 0.808 0 O-C-N 127.288 2.867 . . . . 0.0 113.576 -170.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 111.02 -3.11 28.56 Favored Glycine 0 N--CA 1.421 -2.302 0 N-CA-C 110.692 -0.963 . . . . 0.0 110.692 -173.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.524 ' HB2' ' HB3' ' A' ' 469' ' ' ARG . 12.7 tt0 -115.87 111.89 21.12 Favored 'General case' 0 N--CA 1.403 -2.785 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 173.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 44.7 t30 -136.44 97.68 3.64 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 177.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -139.19 157.88 45.15 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 109.5 -0.555 . . . . 0.0 109.5 176.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 52.4 tttm -90.42 108.0 19.5 Favored 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.42 -1.696 . . . . 0.0 106.42 175.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . . . . . . . . . 4.3 p -74.43 31.42 0.09 Allowed 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.382 1.073 . . . . 0.0 112.973 -176.083 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 36.5 tt0 -66.98 -46.83 73.43 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.628 1.171 . . . . 0.0 112.721 -174.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 -92.88 15.23 15.28 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-O 120.876 0.37 . . . . 0.0 111.452 -176.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 8.4 m0 -76.79 129.53 78.78 Favored Pre-proline 0 C--N 1.311 -1.072 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.74 177.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -70.96 163.54 38.88 Favored 'Trans proline' 0 N--CA 1.45 -1.062 0 C-N-CA 122.45 2.1 . . . . 0.0 109.762 174.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 17.1 mm100 -85.68 -6.08 59.18 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -179.558 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.53 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 93.8 mttt -127.73 132.79 49.55 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.144 177.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.5 mt -118.8 146.19 45.02 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.214 174.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 62.9 mt -102.3 128.24 55.15 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 120.938 0.399 . . . . 0.0 111.096 -174.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 80.6 mtp -100.75 125.39 47.21 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.262 -179.439 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 84.1 mm-40 -107.97 113.54 26.8 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 7.9 mp -85.35 124.74 32.31 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-O 121.246 0.546 . . . . 0.0 111.587 -178.029 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.467 HD11 ' HE1' ' A' ' 512' ' ' MET . 22.5 pt -134.5 161.04 66.08 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 114.765 -1.107 . . . . 0.0 108.456 -177.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . 0.425 ' HD3' HD23 ' A' ' 544' ' ' LEU . 37.3 Cg_endo -72.04 128.68 14.26 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 CA-C-N 120.064 1.059 . . . . 0.0 112.518 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -63.7 -30.36 71.47 Favored 'General case' 0 N--CA 1.469 0.519 0 C-N-CA 124.623 1.169 . . . . 0.0 110.553 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -63.08 -36.13 82.56 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.892 -178.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 540' ' ' VAL . 34.1 tp -87.29 -5.55 58.88 Favored 'General case' 0 C--N 1.314 -0.942 0 CA-C-O 121.632 0.73 . . . . 0.0 111.022 -176.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 59.1 tp -78.01 -16.12 58.36 Favored 'General case' 0 C--N 1.312 -1.027 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.791 -176.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 22.5 p -57.59 -29.21 64.28 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 124.101 0.96 . . . . 0.0 113.101 -174.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 21.4 m -63.18 -29.75 71.04 Favored 'General case' 0 CA--C 1.548 0.892 0 CA-C-O 121.102 0.477 . . . . 0.0 110.757 179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 6.9 mp -88.14 7.92 29.36 Favored 'General case' 0 C--O 1.222 -0.391 0 O-C-N 122.193 -0.317 . . . . 0.0 111.55 -176.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -46.1 -58.03 5.91 Favored Glycine 0 CA--C 1.543 1.792 0 N-CA-C 115.33 0.892 . . . . 0.0 115.33 -178.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -60.9 -22.84 75.49 Favored 'Trans proline' 0 C--N 1.362 1.249 0 C-N-CA 122.672 2.248 . . . . 0.0 113.336 -179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 44.8 tp -72.43 -29.87 64.1 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.016 0.436 . . . . 0.0 109.899 -179.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -75.22 -13.19 60.43 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 115.297 -0.865 . . . . 0.0 113.073 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . 0.474 ' NE ' ' HA ' ' A' ' 466' ' ' ARG . 5.0 mmp_? -61.78 -46.2 90.6 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 120.106 -0.638 . . . . 0.0 111.946 -177.376 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 61.8 t30 -95.13 84.29 4.06 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 108.543 -0.91 . . . . 0.0 108.543 174.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . 0.424 ' HB2' HD23 ' A' ' 525' ' ' LEU . 66.0 m -148.24 169.99 18.86 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.42 -0.809 . . . . 0.0 109.922 179.308 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.524 ' HB3' ' HB2' ' A' ' 437' ' ' GLU . 8.0 mtm180 -111.13 141.98 43.92 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.365 -1.717 . . . . 0.0 106.365 -175.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.545 ' HG2' ' HG ' ' A' ' 525' ' ' LEU . 47.5 mtp -99.73 152.71 19.79 Favored 'General case' 0 N--CA 1.425 -1.717 0 C-N-CA 116.837 -1.945 . . . . 0.0 110.75 -173.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.599 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 23.1 m -134.0 159.45 42.32 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.661 178.031 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -129.44 119.87 24.52 Favored 'General case' 0 C--N 1.291 -1.935 0 CA-C-N 115.281 -0.872 . . . . 0.0 108.752 179.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.5 m-85 -107.42 119.87 40.61 Favored 'General case' 0 C--O 1.29 3.199 0 CA-C-N 115.513 -0.767 . . . . 0.0 111.296 -177.684 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.23 123.22 27.97 Favored 'General case' 0 N--CA 1.42 -1.96 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 174.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . 0.577 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 41.2 m-85 -78.49 144.14 36.0 Favored 'General case' 0 C--N 1.292 -1.916 0 C-N-CA 120.865 -0.334 . . . . 0.0 111.002 -176.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 7.1 m -52.47 -41.5 63.4 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.816 1.246 . . . . 0.0 109.558 -177.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . 0.465 ' C ' ' H ' ' A' ' 479' ' ' ASP . 14.0 m-80 -127.7 142.7 51.26 Favored 'General case' 0 CA--C 1.43 -3.65 0 N-CA-C 101.993 -3.336 . . . . 0.0 101.993 168.666 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.575 ' O ' ' HB2' ' A' ' 483' ' ' LEU . 58.0 mtpt -65.12 -2.37 2.8 Favored 'General case' 0 C--N 1.291 -1.941 0 O-C-N 124.06 0.85 . . . . 0.0 110.116 173.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 477' ' ' ASN . 2.3 t70 45.78 66.27 0.97 Allowed 'General case' 0 CA--C 1.43 -3.637 0 C-N-CA 127.95 2.5 . . . . 0.0 107.938 176.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.418 ' H ' ' HG ' ' A' ' 480' ' ' LEU . 20.0 mt -46.96 -41.29 15.9 Favored 'General case' 0 C--N 1.275 -2.648 0 CA-C-N 110.944 -2.844 . . . . 0.0 112.963 -168.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -72.23 -53.79 11.53 Favored 'General case' 0 CA--C 1.565 1.533 0 C-N-CA 119.065 -1.054 . . . . 0.0 113.035 174.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 7.0 m -73.88 -47.94 34.54 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 113.203 0.816 . . . . 0.0 113.203 -172.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.575 ' HB2' ' O ' ' A' ' 478' ' ' LYS . 30.4 mt -71.07 -22.39 62.12 Favored 'General case' 0 C--O 1.19 -2.029 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 -174.96 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -55.81 -42.65 75.96 Favored 'General case' 0 C--N 1.312 -1.027 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 175.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -70.0 -44.5 61.07 Favored Glycine 0 N--CA 1.442 -0.908 0 CA-C-N 115.244 -0.889 . . . . 0.0 112.13 175.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.08 -41.67 97.23 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 -178.078 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . 0.509 ' CE2' ' HB3' ' A' ' 483' ' ' LEU . 7.0 m-30 -56.23 -42.36 77.14 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.393 0.677 . . . . 0.0 109.774 177.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 26.6 tpt180 -63.29 -48.05 79.75 Favored 'General case' 0 N--CA 1.441 -0.894 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.197 179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 68.6 mt -62.2 -50.54 79.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 123.577 0.548 . . . . 0.0 111.341 -178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 91.6 mmm -63.65 -43.01 98.02 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-O 121.363 0.601 . . . . 0.0 110.427 -177.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -70.34 -12.8 69.88 Favored Glycine 0 CA--C 1.521 0.464 0 CA-C-N 115.696 -0.684 . . . . 0.0 112.685 -179.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 10.2 t30 -88.5 11.04 18.18 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 122.287 1.041 . . . . 0.0 109.201 179.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.91 30.07 6.94 Favored Glycine 0 N--CA 1.434 -1.475 0 C-N-CA 120.638 -0.791 . . . . 0.0 113.106 177.205 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 65.0 m-85 -113.38 145.16 41.57 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 117.098 0.449 . . . . 0.0 111.367 176.217 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -124.46 153.47 41.93 Favored 'General case' 0 C--N 1.296 -1.725 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -179.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -114.16 107.39 1.85 Allowed Glycine 0 N--CA 1.422 -2.24 0 C-N-CA 120.34 -0.933 . . . . 0.0 111.204 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 49.5 t -82.42 121.04 26.21 Favored 'General case' 0 C--N 1.296 -1.744 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.0 t -100.8 120.8 50.79 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.197 0 CA-C-O 121.687 0.756 . . . . 0.0 109.588 -174.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -107.6 143.23 36.35 Favored 'General case' 0 C--N 1.29 -1.985 0 CA-C-N 113.861 -1.518 . . . . 0.0 107.84 178.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -100.19 129.26 28.57 Favored Pre-proline 0 C--N 1.284 -2.268 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.61 -176.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -60.87 134.88 56.09 Favored 'Trans proline' 0 C--O 1.245 0.858 0 N-CA-C 107.19 -1.889 . . . . 0.0 107.19 169.175 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 41.0 m-70 -78.28 114.15 16.91 Favored 'General case' 0 C--N 1.305 -1.355 0 C-N-CA 118.5 -1.28 . . . . 0.0 113.373 -173.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 21.0 m -111.72 -36.46 5.45 Favored 'General case' 0 C--N 1.292 -1.903 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 170.498 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.98 117.37 68.64 Favored Pre-proline 0 N--CA 1.429 -1.514 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 169.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -83.06 -2.03 10.61 Favored 'Trans proline' 0 C--N 1.328 -0.541 0 C-N-CA 122.407 2.071 . . . . 0.0 114.192 -177.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 59.8 m -111.79 -78.42 0.58 Allowed 'General case' 0 C--N 1.312 -1.038 0 C-N-CA 119.733 -0.787 . . . . 0.0 111.1 179.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -121.28 117.45 27.05 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 120.959 0.409 . . . . 0.0 109.913 -177.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 8.8 p -110.64 -31.45 2.27 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 109.518 -0.549 . . . . 0.0 109.518 177.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.484 ' HG2' ' HA ' ' A' ' 528' ' ' TYR . 4.7 mtm180 72.69 165.47 0.29 Allowed 'General case' 0 C--N 1.373 1.612 0 C-N-CA 124.853 1.261 . . . . 0.0 109.071 -178.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 15.9 m -128.63 163.92 32.0 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.945 0 C-N-CA 117.766 -1.574 . . . . 0.0 111.404 -178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.551 ' HB2' HG12 ' A' ' 526' ' ' ILE . 12.3 tp -125.88 145.87 50.07 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-O 121.279 0.561 . . . . 0.0 112.346 -173.206 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . 0.467 ' HE1' HD11 ' A' ' 453' ' ' ILE . 38.5 tpp -115.24 117.81 31.55 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 109.271 -0.64 . . . . 0.0 109.271 174.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.533 HD11 ' HB3' ' A' ' 522' ' ' PHE . 48.3 tp -100.03 121.17 40.96 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-O 121.239 0.542 . . . . 0.0 109.995 -178.472 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 75.9 mt -124.17 130.02 51.81 Favored 'General case' 0 C--N 1.297 -1.688 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.45 -177.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -90.13 127.45 36.1 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 178.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.8 p -101.46 110.76 22.81 Favored 'General case' 0 N--CA 1.401 -2.876 0 N-CA-C 106.934 -1.506 . . . . 0.0 106.934 174.389 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 7.9 m -68.5 -34.36 75.76 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 114.123 -1.399 . . . . 0.0 111.197 -177.204 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 25.3 ttmm -74.46 -27.9 60.8 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.743 -179.213 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 1.3 mmmp? -99.0 -9.89 23.37 Favored 'General case' 0 C--N 1.307 -1.273 0 C-N-CA 120.461 -0.496 . . . . 0.0 109.861 -178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? 59.74 31.01 20.59 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.467 1.107 . . . . 0.0 111.797 -178.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -144.82 167.48 10.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 112.261 0.467 . . . . 0.0 112.261 -176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.533 ' HB3' HD11 ' A' ' 513' ' ' LEU . 30.1 m-85 -102.56 138.33 39.61 Favored 'General case' 0 N--CA 1.42 -1.936 0 C-N-CA 119.321 -0.952 . . . . 0.0 110.283 -179.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 25.8 ptm -127.01 159.57 33.73 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -165.89 153.08 22.79 Favored Glycine 0 N--CA 1.42 -2.38 0 C-N-CA 118.437 -1.839 . . . . 0.0 112.67 178.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.545 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 9.6 mp -115.58 139.21 50.3 Favored 'General case' 0 C--N 1.29 -1.987 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 171.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.551 HG12 ' HB2' ' A' ' 511' ' ' LEU . 25.0 mt -105.67 107.46 59.41 Favored Pre-proline 0 N--CA 1.428 -1.558 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 175.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.567 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 25.4 Cg_exo -70.93 138.0 33.2 Favored 'Trans proline' 0 C--O 1.295 3.359 0 C-N-CA 123.027 2.485 . . . . 0.0 112.316 171.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . 0.484 ' HA ' ' HG2' ' A' ' 509' ' ' ARG . 96.9 m-85 -71.65 -41.43 68.79 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 113.3 -1.773 . . . . 0.0 110.28 -179.64 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -77.48 89.71 3.84 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.353 -176.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -67.5 -44.98 77.18 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.002 -0.999 . . . . 0.0 111.71 -177.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.1 m -60.36 -46.85 88.47 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 112.818 0.674 . . . . 0.0 112.818 -174.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -75.85 -38.48 36.18 Favored Glycine 0 N--CA 1.437 -1.273 0 C-N-CA 120.828 -0.701 . . . . 0.0 112.453 -177.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.548 ' O ' HG12 ' A' ' 537' ' ' ILE . 46.4 t80 -63.98 -47.57 79.82 Favored 'General case' 0 N--CA 1.451 -0.399 0 N-CA-C 110.044 -0.354 . . . . 0.0 110.044 -179.109 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 93.5 t -61.45 -38.85 81.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-O 121.09 0.471 . . . . 0.0 110.038 178.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -62.44 -41.18 98.55 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.352 178.632 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.99 -41.15 93.37 Favored Glycine 0 N--CA 1.446 -0.642 0 N-CA-C 111.43 -0.668 . . . . 0.0 111.43 177.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.548 HG12 ' O ' ' A' ' 533' ' ' PHE . 46.7 mm -62.72 -35.52 71.05 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 122.757 0.423 . . . . 0.0 111.122 179.406 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 74.6 mtp180 -55.92 -38.59 70.46 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-O 121.05 0.452 . . . . 0.0 111.301 177.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 15.9 mt-30 -68.99 -44.27 73.2 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.301 178.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 457' ' ' LEU . 48.6 t -62.39 -42.26 94.9 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.176 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.439 ' O ' ' HG2' ' A' ' 545' ' ' GLU . 73.8 mt -60.54 -45.14 97.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.389 0 C-N-CA 123.328 0.651 . . . . 0.0 109.708 176.841 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 60.2 m -58.7 -41.53 86.49 Favored 'General case' 0 C--O 1.25 1.127 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.112 179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -68.11 -42.93 79.53 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.455 175.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.425 HD23 ' HD3' ' A' ' 454' ' ' PRO . 2.8 tm? -60.12 -37.76 81.01 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.659 0.784 . . . . 0.0 111.726 -179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . 0.439 ' HG2' ' O ' ' A' ' 541' ' ' ILE . 79.7 mm-40 -58.06 -32.88 68.45 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.102 0.477 . . . . 0.0 111.357 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 77.9 m80 -96.39 -20.91 18.1 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.854 -178.0 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 38.3 m80 65.63 174.73 0.22 Allowed 'General case' 0 C--O 1.249 1.076 0 C-N-CA 124.774 1.23 . . . . 0.0 110.474 -175.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 44.5 m80 -81.9 77.9 8.67 Favored 'General case' 0 C--N 1.313 -0.984 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 174.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 55.1 p-80 -96.04 14.71 22.84 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.426 -174.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -146.69 -56.31 0.26 Allowed 'General case' 0 C--N 1.3 -1.557 0 N-CA-C 109.055 -0.721 . . . . 0.0 109.055 -177.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.2 p80 . . . . . 0 C--N 1.296 -1.754 0 CA-C-N 115.434 -0.803 . . . . 0.0 109.602 179.816 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 43.0 tpp . . . . . 0 N--CA 1.454 -0.229 0 CA-C-O 120.564 0.221 . . . . 0.0 110.915 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 29.9 t -126.12 116.74 21.84 Favored 'General case' 0 N--CA 1.425 -1.691 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . 0.484 HG13 ' H ' ' A' ' 397' ' ' ASN . 7.6 p -142.01 -32.97 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 CA-C-N 115.376 -0.829 . . . . 0.0 110.205 178.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 21.1 t 62.78 38.8 11.45 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 108.298 -1.001 . . . . 0.0 108.298 -179.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . 0.484 ' H ' HG13 ' A' ' 395' ' ' VAL . 3.2 p-10 -69.0 147.48 51.53 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-N 115.455 -0.793 . . . . 0.0 109.273 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . 0.564 ' H ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -127.93 153.66 46.43 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.647 -174.379 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.402 ' HB2' HG23 ' A' ' 433' ' ' VAL . 2.9 mp -106.16 132.47 52.19 Favored 'General case' 0 C--N 1.265 -3.091 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 -175.297 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -70.58 128.87 37.59 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 177.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -118.59 -62.88 1.48 Allowed 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -175.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.472 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 52.1 t90 -140.11 145.95 38.25 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.495 -0.482 . . . . 0.0 111.357 -171.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 20.6 t -126.26 121.52 32.91 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 105.244 -2.132 . . . . 0.0 105.244 175.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.472 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -169.56 -172.09 35.82 Favored Glycine 0 N--CA 1.44 -1.045 0 C-N-CA 119.93 -1.129 . . . . 0.0 112.443 -175.131 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.402 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 49.7 t -109.55 139.23 33.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.485 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.551 HD12 ' HB2' ' A' ' 448' ' ' LEU . 9.2 tp -113.91 132.2 56.01 Favored 'General case' 0 N--CA 1.409 -2.514 0 N-CA-C 105.945 -1.872 . . . . 0.0 105.945 179.943 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . . . . . . . . . 16.8 tt0 -115.62 125.85 53.44 Favored 'General case' 0 N--CA 1.419 -2.012 0 N-CA-C 106.628 -1.619 . . . . 0.0 106.628 -178.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 41.1 p-90 -132.18 145.89 51.66 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-O 121.04 0.447 . . . . 0.0 111.143 -171.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -101.21 131.61 47.12 Favored 'General case' 0 N--CA 1.42 -1.954 0 N-CA-C 109.38 -0.6 . . . . 0.0 109.38 179.014 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -78.96 -31.8 45.13 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.815 -1.084 . . . . 0.0 109.587 -177.528 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 24.7 mtpp -94.47 116.45 66.41 Favored Pre-proline 0 C--N 1.305 -1.341 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.706 -177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_exo -59.41 -25.34 78.2 Favored 'Trans proline' 0 N--CA 1.485 0.996 0 C-N-CA 123.218 2.612 . . . . 0.0 113.773 -176.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.411 ' HD3' ' O ' ' A' ' 544' ' ' LEU . 22.1 pttm -146.48 150.24 39.92 Favored Pre-proline 0 C--N 1.313 -0.99 0 N-CA-C 109.071 -0.714 . . . . 0.0 109.071 178.617 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.52 79.85 2.1 Favored 'Trans proline' 0 N--CA 1.446 -1.302 0 C-N-CA 121.951 1.768 . . . . 0.0 111.081 174.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -99.07 2.94 46.58 Favored 'General case' 0 C--N 1.312 -1.064 0 CA-C-N 114.68 -1.145 . . . . 0.0 108.613 178.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 58.5 m -53.6 116.8 2.67 Favored 'General case' 0 N--CA 1.418 -2.055 0 N-CA-C 116.177 1.918 . . . . 0.0 116.177 -175.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 21.4 t -118.84 17.81 6.81 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 N-CA-C 102.757 -3.053 . . . . 0.0 102.757 166.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -107.7 137.35 45.87 Favored 'General case' 0 N--CA 1.438 -1.028 0 CA-C-N 112.405 -2.18 . . . . 0.0 111.628 -176.022 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.62 -28.88 20.37 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 115.354 -0.839 . . . . 0.0 109.575 175.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 19.5 t30 -65.12 117.61 7.97 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.698 -179.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 20.5 m 60.61 90.23 0.06 Allowed 'General case' 0 N--CA 1.447 -0.612 0 CA-C-O 122.409 1.1 . . . . 0.0 110.945 178.911 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.57 6.07 19.83 Favored 'General case' 0 C--N 1.291 -1.945 0 O-C-N 121.625 -0.672 . . . . 0.0 109.397 -178.581 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 90.5 mt -110.69 147.28 34.67 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.815 -177.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 3.6 m -66.35 146.08 54.98 Favored 'General case' 0 C--N 1.312 -1.042 0 N-CA-C 107.332 -1.359 . . . . 0.0 107.332 173.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 8.0 mmm180 -91.27 146.66 23.64 Favored 'General case' 0 C--N 1.313 -0.983 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -174.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 46.9 p -125.46 131.53 52.84 Favored 'General case' 0 C--N 1.292 -1.911 0 CA-C-O 120.926 0.393 . . . . 0.0 111.484 -175.115 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 482' ' ' SER . 62.1 mt -136.16 127.38 16.94 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 122.754 0.422 . . . . 0.0 111.977 -178.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_exo -73.43 134.47 20.74 Favored 'Trans proline' 0 C--O 1.254 1.312 0 C-N-CA 122.385 2.056 . . . . 0.0 110.791 175.222 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.3 p -141.91 161.54 37.71 Favored 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.694 -177.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -116.98 129.78 56.26 Favored 'General case' 0 N--CA 1.429 -1.495 0 N-CA-C 107.473 -1.306 . . . . 0.0 107.473 177.259 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 54.7 t -112.36 124.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.423 -1.795 0 CA-C-O 121.739 0.78 . . . . 0.0 110.502 -175.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 89.3 m-85 -107.86 155.37 20.35 Favored 'General case' 0 C--N 1.28 -2.428 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 175.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 471' ' ' VAL . 18.1 m -122.27 139.31 49.61 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.184 0 N-CA-C 109.586 -0.524 . . . . 0.0 109.586 177.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.635 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 37.0 t30 -98.33 130.86 45.0 Favored 'General case' 1 C--O 1.309 4.219 0 CA-C-N 115.517 -0.765 . . . . 0.0 109.502 168.703 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.485 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 80.0 m80 -19.53 152.9 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 131.166 3.786 . . . . 0.0 118.201 -170.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 110.76 -1.16 28.89 Favored Glycine 0 C--O 1.244 0.769 0 CA-C-N 114.795 -1.093 . . . . 0.0 111.488 -178.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.567 ' HG3' HG21 ' A' ' 433' ' ' VAL . 0.0 OUTLIER -97.19 146.31 25.2 Favored 'General case' 0 C--N 1.286 -2.194 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 -174.063 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 33.0 t30 -155.95 93.41 1.44 Allowed 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 106.584 -1.636 . . . . 0.0 106.584 160.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 1.5 pt? -142.26 146.4 35.09 Favored 'General case' 0 C--N 1.281 -2.385 0 CA-C-N 114.09 -1.413 . . . . 0.0 107.539 174.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . 0.514 ' O ' ' HG2' ' A' ' 443' ' ' GLN . 19.4 ptmt -102.25 129.41 48.64 Favored 'General case' 0 C--N 1.282 -2.359 0 C-N-CA 118.665 -1.214 . . . . 0.0 110.185 175.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.448 HG21 ' HB2' ' A' ' 402' ' ' TRP . 8.0 p -83.56 1.15 43.46 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-O 122.086 0.946 . . . . 0.0 111.435 -175.758 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -64.08 -30.12 71.21 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.687 174.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . 0.514 ' HG2' ' O ' ' A' ' 440' ' ' LYS . 4.4 pt20 -101.29 17.22 23.13 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.627 -176.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 10.2 m0 -95.94 141.84 23.73 Favored Pre-proline 0 C--N 1.312 -1.059 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.257 177.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.85 163.04 35.01 Favored 'Trans proline' 0 N--CA 1.459 -0.537 0 C-N-CA 122.187 1.925 . . . . 0.0 109.74 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . 0.308 2.7 pp0? -97.55 -7.78 30.54 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.992 1.108 . . . . 0.0 113.992 -177.19 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 14.0 mptt -127.88 113.77 16.33 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.786 0.834 . . . . 0.0 109.67 169.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . 0.551 ' HB2' HD12 ' A' ' 406' ' ' LEU . 50.3 mt -103.38 147.12 27.5 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 177.567 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 46.5 mm -99.35 122.52 51.23 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.067 0 CA-C-O 120.887 0.375 . . . . 0.0 110.543 -174.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.424 ' SD ' HD23 ' A' ' 513' ' ' LEU . 57.9 ttp -112.08 121.82 46.04 Favored 'General case' 0 C--N 1.308 -1.23 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.711 178.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . 0.454 ' HB2' ' SG ' ' A' ' 497' ' ' CYS . 12.4 mm-40 -106.91 133.62 51.29 Favored 'General case' 0 C--N 1.308 -1.222 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 178.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.503 HD13 HG21 ' A' ' 489' ' ' ILE . 88.1 mt -91.29 115.87 28.37 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.473 0.654 . . . . 0.0 111.391 -177.076 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.448 ' HA ' HD11 ' A' ' 544' ' ' LEU . 39.6 pt -116.9 161.76 30.79 Favored Pre-proline 0 C--N 1.311 -1.077 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.078 -177.517 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . 0.451 ' HD3' HD11 ' A' ' 544' ' ' LEU . 8.4 Cg_exo -71.54 129.68 16.09 Favored 'Trans proline' 0 C--O 1.244 0.806 0 C-N-CA 121.464 1.443 . . . . 0.0 110.919 179.682 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -62.75 -28.15 69.77 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.5 0.72 . . . . 0.0 111.148 -178.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . 0.41 ' CD ' ' H ' ' A' ' 456' ' ' GLN . 19.3 mp0 -63.89 -40.7 97.13 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.132 -176.906 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.8 mt -77.81 -11.47 59.89 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.198 -177.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 57.1 tp -82.69 -19.33 38.32 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.044 -178.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.0 m -58.28 -28.55 65.06 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 122.959 0.503 . . . . 0.0 111.134 -177.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 15.7 m -61.37 -27.62 68.65 Favored 'General case' 0 CA--C 1.56 1.329 0 C-N-CA 123.488 0.715 . . . . 0.0 111.195 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 7.0 mp -92.07 8.42 37.86 Favored 'General case' 0 N--CA 1.462 0.128 0 CA-C-N 116.492 -0.322 . . . . 0.0 111.628 -176.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . 0.426 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -45.96 -52.25 10.08 Favored Glycine 0 CA--C 1.545 1.933 0 N-CA-C 114.891 0.716 . . . . 0.0 114.891 179.532 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . 0.426 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 11.8 Cg_endo -56.14 -28.62 71.3 Favored 'Trans proline' 0 C--N 1.372 1.763 0 C-N-CA 122.88 2.387 . . . . 0.0 113.405 178.084 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 42.4 tp -75.93 -29.89 58.53 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.202 0.525 . . . . 0.0 110.762 -177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -72.99 -12.61 61.0 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.987 -0.551 . . . . 0.0 112.183 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -68.83 -20.48 64.31 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.905 -0.589 . . . . 0.0 111.777 -179.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -127.21 84.66 2.28 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-O 121.334 0.588 . . . . 0.0 109.482 179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.4 m -158.15 170.32 22.55 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-N 115.686 -0.688 . . . . 0.0 110.122 -178.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -110.45 143.75 40.28 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 124.326 1.051 . . . . 0.0 109.61 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.635 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 32.2 mmm -96.39 152.06 18.95 Favored 'General case' 0 CA--C 1.481 -1.685 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 -165.522 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.605 HG12 HG12 ' A' ' 433' ' ' VAL . 4.8 m -142.27 162.08 19.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.511 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 178.732 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -133.84 130.03 37.32 Favored 'General case' 0 C--N 1.295 -1.801 0 N-CA-C 108.867 -0.79 . . . . 0.0 108.867 178.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -110.95 117.62 33.87 Favored 'General case' 0 C--O 1.274 2.389 0 CA-C-O 121.734 0.778 . . . . 0.0 111.015 -178.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -114.51 122.71 47.4 Favored 'General case' 0 N--CA 1.422 -1.872 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 173.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -90.78 150.48 21.58 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.634 -0.257 . . . . 0.0 110.66 -177.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 77.4 p -82.64 138.64 34.1 Favored 'General case' 0 N--CA 1.418 -2.07 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 27.7 p-10 -76.44 47.9 0.51 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 122.283 1.04 . . . . 0.0 109.955 177.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -81.85 -40.37 22.55 Favored 'General case' 0 N--CA 1.436 -1.134 0 CA-C-N 114.444 -1.253 . . . . 0.0 109.118 -177.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 10.2 t0 -135.19 90.77 2.66 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 79.1 mt -67.4 -24.27 65.65 Favored 'General case' 0 C--N 1.307 -1.277 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.3 mm-40 -69.53 -42.33 74.79 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 121.275 0.559 . . . . 0.0 110.865 -178.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . 0.484 ' HB3' HD21 ' A' ' 427' ' ' LEU . 8.5 t -72.22 -38.35 69.0 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 178.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 80.7 mt -62.76 -43.78 97.89 Favored 'General case' 0 C--O 1.211 -0.941 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.276 177.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -55.04 -43.04 73.4 Favored 'General case' 0 C--O 1.248 0.997 0 C-N-CA 123.312 0.645 . . . . 0.0 110.587 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.499 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.96 -46.44 59.49 Favored Glycine 0 N--CA 1.441 -0.989 0 N-CA-C 111.059 -0.816 . . . . 0.0 111.059 177.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 42.4 tp -58.41 -44.3 88.96 Favored 'General case' 0 C--N 1.323 -0.556 0 C-N-CA 123.544 0.737 . . . . 0.0 111.267 179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -60.35 -40.33 90.34 Favored 'General case' 0 CA--C 1.509 -0.628 0 C-N-CA 122.654 0.382 . . . . 0.0 111.16 177.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.1 ttm180 -66.58 -44.04 83.33 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.018 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.503 HG21 HD13 ' A' ' 452' ' ' LEU . 66.2 mt -65.78 -44.4 93.07 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 CA-C-O 121.159 0.504 . . . . 0.0 109.834 -179.588 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.4 mmt -63.87 -43.01 97.37 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.041 177.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.16 -15.36 69.74 Favored Glycine 0 N--CA 1.447 -0.606 0 CA-C-N 116.08 -0.509 . . . . 0.0 112.215 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -84.72 -4.24 58.95 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-O 121.396 0.617 . . . . 0.0 109.891 179.446 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.56 30.42 6.54 Favored Glycine 0 N--CA 1.443 -0.88 0 C-N-CA 120.104 -1.046 . . . . 0.0 113.739 177.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.8 m-85 -103.4 161.75 13.58 Favored 'General case' 0 C--N 1.305 -1.364 0 CA-C-O 120.64 0.257 . . . . 0.0 110.342 174.633 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -127.95 153.12 47.07 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 178.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -112.31 107.53 2.07 Favored Glycine 0 N--CA 1.424 -2.152 0 C-N-CA 120.203 -0.998 . . . . 0.0 112.4 -177.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . 0.454 ' SG ' ' HB2' ' A' ' 451' ' ' GLN . 17.6 p -84.44 117.32 23.57 Favored 'General case' 0 C--N 1.293 -1.882 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.8 t -101.13 120.41 50.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.881 0 CA-C-O 121.962 0.887 . . . . 0.0 109.303 -177.682 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.0 m80 -112.81 143.24 44.39 Favored 'General case' 0 N--CA 1.411 -2.4 0 CA-C-N 113.145 -1.843 . . . . 0.0 107.763 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . 0.435 ' CD2' HG11 ' A' ' 508' ' ' VAL . 15.8 m-85 -98.68 126.48 38.81 Favored Pre-proline 0 C--N 1.268 -2.969 0 N-CA-C 106.739 -1.578 . . . . 0.0 106.739 -178.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.23 113.38 1.51 Allowed 'Trans proline' 0 C--O 1.244 0.819 0 C-N-CA 122.536 2.157 . . . . 0.0 112.992 -177.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 58.7 m-70 -77.45 124.32 27.73 Favored 'General case' 0 N--CA 1.427 -1.625 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 177.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 9.4 t 172.32 -25.31 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.826 0 N-CA-C 105.727 -1.953 . . . . 0.0 105.727 -173.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -83.84 150.27 58.6 Favored Pre-proline 0 N--CA 1.428 -1.561 0 N-CA-C 107.141 -1.429 . . . . 0.0 107.141 171.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 83.0 Cg_endo -76.97 1.94 8.11 Favored 'Trans proline' 0 N--CA 1.478 0.591 0 C-N-CA 122.973 2.448 . . . . 0.0 113.179 -177.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 49.7 t -85.06 142.96 29.19 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.426 -178.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -89.95 92.9 9.19 Favored 'General case' 0 N--CA 1.423 -1.805 0 N-CA-C 106.4 -1.704 . . . . 0.0 106.4 173.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.435 HG11 ' CD2' ' A' ' 500' ' ' PHE . 4.6 t -88.35 137.81 20.39 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.133 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 -176.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.624 ' HD2' ' O ' ' A' ' 528' ' ' TYR . 19.4 mmt180 -81.2 171.15 15.23 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 179.029 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.547 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 24.2 m -109.44 165.87 5.12 Favored 'Isoleucine or valine' 0 C--O 1.202 -1.402 0 C-N-CA 117.966 -1.494 . . . . 0.0 112.077 -171.982 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.567 ' HB2' HG12 ' A' ' 526' ' ' ILE . 1.0 OUTLIER -133.01 134.42 44.42 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 119.542 -0.863 . . . . 0.0 112.118 -177.505 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . 0.416 ' N ' HD22 ' A' ' 511' ' ' LEU . 35.0 tpp -102.46 121.36 42.19 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 109.011 -0.736 . . . . 0.0 109.011 175.639 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.662 HD11 ' HB3' ' A' ' 522' ' ' PHE . 31.8 tp -106.95 125.29 50.81 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-O 121.622 0.725 . . . . 0.0 110.523 -178.124 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 59.4 mt -124.28 148.83 47.12 Favored 'General case' 0 C--N 1.291 -1.969 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.237 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 59.2 t80 -100.04 124.0 44.92 Favored 'General case' 0 C--N 1.271 -2.827 0 CA-C-N 116.225 -0.443 . . . . 0.0 110.359 -178.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 34.8 p -93.9 110.42 22.09 Favored 'General case' 0 N--CA 1.417 -2.116 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 173.261 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.8 p -68.92 -35.49 76.87 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 114.352 -1.294 . . . . 0.0 113.061 -175.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -72.92 -24.17 60.78 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-O 121.65 0.738 . . . . 0.0 110.327 -176.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -105.24 -9.81 17.45 Favored 'General case' 0 C--N 1.309 -1.184 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.257 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 48.9 mmtm 61.09 24.13 14.26 Favored 'General case' 0 C--O 1.244 0.813 0 C-N-CA 124.736 1.214 . . . . 0.0 111.598 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -133.0 167.65 26.17 Favored 'Isoleucine or valine' 0 C--O 1.244 0.767 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.687 -174.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.662 ' HB3' HD11 ' A' ' 513' ' ' LEU . 24.4 m-85 -102.31 138.87 38.68 Favored 'General case' 0 N--CA 1.427 -1.586 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.314 -175.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 14.7 tmm? -133.81 141.63 47.53 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -177.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . 0.403 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -152.69 159.12 28.27 Favored Glycine 0 N--CA 1.431 -1.663 0 C-N-CA 118.861 -1.637 . . . . 0.0 113.465 -178.049 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.55 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.6 mp -115.6 139.96 49.62 Favored 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 173.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.567 HG12 ' HB2' ' A' ' 511' ' ' LEU . 12.4 mt -97.97 107.98 43.73 Favored Pre-proline 0 C--O 1.249 1.072 0 N-CA-C 110.032 -0.359 . . . . 0.0 110.032 177.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.55 ' HD3' ' O ' ' A' ' 525' ' ' LEU . 23.8 Cg_exo -72.06 133.13 20.85 Favored 'Trans proline' 0 C--O 1.294 3.301 0 C-N-CA 123.231 2.621 . . . . 0.0 112.289 171.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . 0.624 ' O ' ' HD2' ' A' ' 509' ' ' ARG . 70.4 m-85 -74.89 -41.3 60.02 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 113.231 -1.804 . . . . 0.0 110.571 -178.504 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -84.03 91.95 7.75 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.944 0.878 . . . . 0.0 110.184 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.33 -37.34 83.13 Favored 'General case' 0 C--N 1.294 -1.829 0 CA-C-N 114.201 -1.363 . . . . 0.0 113.138 179.104 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 22.6 t -61.0 -47.71 85.21 Favored 'General case' 0 C--O 1.243 0.763 0 N-CA-C 111.959 0.355 . . . . 0.0 111.959 -175.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.68 -36.54 37.22 Favored Glycine 0 N--CA 1.437 -1.244 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.818 -178.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.466 ' O ' HG12 ' A' ' 537' ' ' ILE . 50.2 t80 -66.22 -47.34 74.16 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 -178.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 88.2 t -65.24 -38.36 82.43 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.466 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.052 179.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -59.17 -38.56 80.06 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.38 0.61 . . . . 0.0 110.187 176.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -70.53 -46.3 48.69 Favored Glycine 0 N--CA 1.441 -1.029 0 N-CA-C 111.35 -0.7 . . . . 0.0 111.35 177.715 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 533' ' ' PHE . 51.6 mm -67.33 -36.15 75.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 N-CA-C 112.262 0.467 . . . . 0.0 112.262 -177.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -56.33 -43.19 78.8 Favored 'General case' 0 C--O 1.213 -0.857 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 178.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 53.4 tt0 -59.64 -40.45 87.7 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.647 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 56.5 t -67.28 -46.56 83.68 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.066 179.293 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.5 ' O ' ' HG3' ' A' ' 545' ' ' GLU . 77.0 mt -62.71 -45.25 99.29 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-O 121.302 0.572 . . . . 0.0 109.935 178.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . 0.447 ' HA ' ' OE1' ' A' ' 545' ' ' GLU . 21.8 m -63.37 -33.56 75.81 Favored 'General case' 0 N--CA 1.426 -1.659 0 CA-C-N 115.433 -0.803 . . . . 0.0 112.907 177.332 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -64.63 -44.08 91.66 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 173.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.451 HD11 ' HD3' ' A' ' 454' ' ' PRO . 96.8 mt -57.66 -35.89 71.15 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 123.486 0.714 . . . . 0.0 111.733 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . 0.5 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 47.0 mt-10 -65.67 -27.5 68.41 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.079 0.552 . . . . 0.0 111.516 179.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 12.5 t60 -97.46 -36.71 10.25 Favored 'General case' 0 CA--C 1.552 1.051 0 CA-C-N 115.769 -0.651 . . . . 0.0 110.406 -177.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -72.88 113.14 9.58 Favored 'General case' 0 C--N 1.314 -0.95 0 C-N-CA 124.469 1.108 . . . . 0.0 108.96 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 38.4 m170 -56.34 -74.21 0.05 Allowed 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.554 0.742 . . . . 0.0 112.206 -177.093 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 12.1 t60 -144.47 -44.73 0.25 Allowed 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 48.1 t-80 -154.77 136.12 14.1 Favored 'General case' 0 N--CA 1.43 -1.472 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 174.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 43.1 m-70 . . . . . 0 C--N 1.294 -1.806 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 175.597 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 24.8 mmt . . . . . 0 CA--C 1.501 -0.93 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 21.1 m -86.42 80.78 8.56 Favored 'General case' 0 N--CA 1.431 -1.387 0 N-CA-C 109.111 -0.7 . . . . 0.0 109.111 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 34.1 m -102.22 179.32 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.577 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 6.1 m -69.36 -51.88 32.53 Favored 'General case' 0 N--CA 1.429 -1.475 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -177.141 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 68.18 -52.3 0.54 Allowed 'General case' 0 N--CA 1.495 1.799 0 C-N-CA 124.796 1.238 . . . . 0.0 111.029 -177.479 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . 0.458 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -107.61 136.77 46.81 Favored 'General case' 0 N--CA 1.415 -2.18 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 174.778 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 3.7 mp -112.6 137.05 51.42 Favored 'General case' 0 C--N 1.287 -2.138 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -62.59 125.14 22.92 Favored 'General case' 0 C--O 1.242 0.664 0 N-CA-C 109.269 -0.641 . . . . 0.0 109.269 -179.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -111.9 -64.65 1.26 Allowed 'General case' 0 N--CA 1.427 -1.578 0 CA-C-N 116.265 -0.425 . . . . 0.0 112.09 -177.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.587 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 69.1 t90 -161.61 150.09 15.53 Favored 'General case' 0 N--CA 1.432 -1.359 0 N-CA-C 108.771 -0.825 . . . . 0.0 108.771 -169.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 16.5 m -129.47 117.82 21.13 Favored 'General case' 0 C--N 1.276 -2.596 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 175.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.587 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -155.1 -172.39 22.73 Favored Glycine 0 N--CA 1.424 -2.15 0 C-N-CA 119.752 -1.213 . . . . 0.0 113.152 -174.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.421 ' HA ' ' HA ' ' A' ' 428' ' ' PRO . 61.6 t -109.28 140.71 26.96 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 -176.133 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 84.4 mt -113.26 128.14 56.38 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.594 ' HG2' HG22 ' A' ' 424' ' ' THR . 25.6 tt0 -117.21 126.08 52.2 Favored 'General case' 0 N--CA 1.41 -2.437 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 -177.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 56.4 p-90 -126.96 147.95 50.09 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.36 0.664 . . . . 0.0 110.085 -174.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . 0.436 ' HA ' ' HA ' ' A' ' 424' ' ' THR . 45.5 tt0 -99.42 138.95 35.79 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 120.662 -0.415 . . . . 0.0 111.58 -175.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . 0.442 ' O ' ' HD3' ' A' ' 412' ' ' PRO . 45.3 mt-10 -77.05 112.46 13.71 Favored 'General case' 0 N--CA 1.436 -1.159 0 N-CA-C 106.691 -1.596 . . . . 0.0 106.691 170.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -111.65 96.56 33.14 Favored Pre-proline 0 C--N 1.302 -1.461 0 CA-C-N 116.354 -0.384 . . . . 0.0 111.406 -176.129 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . 0.442 ' HD3' ' O ' ' A' ' 410' ' ' GLU . 1.0 OUTLIER -87.94 -72.66 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 122.446 2.097 . . . . 0.0 109.352 172.202 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 24.9 pttm -174.79 136.9 0.57 Allowed Pre-proline 0 N--CA 1.438 -1.062 0 N-CA-C 105.971 -1.863 . . . . 0.0 105.971 173.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -82.44 113.26 2.29 Favored 'Trans proline' 0 N--CA 1.441 -1.585 0 C-N-CA 121.424 1.416 . . . . 0.0 110.91 177.611 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -76.96 -24.2 52.34 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-O 121.582 0.706 . . . . 0.0 110.261 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 14.1 m -115.06 167.37 10.87 Favored 'General case' 0 C--N 1.304 -1.371 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.287 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 65.5 t -74.74 100.99 1.76 Allowed 'Isoleucine or valine' 0 C--N 1.32 -0.71 0 N-CA-C 108.139 -1.059 . . . . 0.0 108.139 177.483 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -136.2 137.83 41.26 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 116.081 -0.508 . . . . 0.0 110.715 -177.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.38 -38.81 14.79 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.154 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 175.71 83.14 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.821 1.249 . . . . 0.0 110.178 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 8.9 m -128.79 7.39 5.64 Favored 'General case' 0 C--N 1.293 -1.852 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 171.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . 0.514 ' HA ' ' HE3' ' A' ' 422' ' ' LYS . 0.0 OUTLIER -79.5 152.48 30.19 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 175.785 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 94.4 mt -59.53 113.92 2.45 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-O 122.045 0.926 . . . . 0.0 113.04 -175.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . 0.594 HG22 ' HG2' ' A' ' 407' ' ' GLU . 6.8 m -100.53 134.9 42.8 Favored 'General case' 0 N--CA 1.418 -2.057 0 N-CA-C 106.433 -1.692 . . . . 0.0 106.433 176.672 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 24.1 mmt180 -109.73 145.81 35.97 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 -175.535 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . . . . . . . . . 56.3 p -123.13 130.1 52.32 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 121.134 -0.226 . . . . 0.0 110.863 -176.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 428' ' ' PRO . 92.5 mt -130.55 125.94 21.78 Favored Pre-proline 0 C--N 1.316 -0.861 0 O-C-N 123.192 0.308 . . . . 0.0 111.094 179.671 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 427' ' ' LEU . 8.7 Cg_exo -75.84 142.34 25.29 Favored 'Trans proline' 0 C--O 1.251 1.142 0 C-N-CA 123.043 2.496 . . . . 0.0 112.182 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . 0.417 ' HA ' ' HA ' ' A' ' 475' ' ' PHE . 23.1 p -141.13 168.57 19.46 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.2 -176.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -115.7 129.53 56.51 Favored 'General case' 0 C--N 1.302 -1.481 0 N-CA-C 104.953 -2.239 . . . . 0.0 104.953 176.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 22.8 t -122.79 123.92 69.33 Favored 'Isoleucine or valine' 0 C--O 1.256 1.446 0 CA-C-O 121.874 0.845 . . . . 0.0 110.274 -176.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . 0.474 ' HB2' ' HB3' ' A' ' 472' ' ' GLN . 78.0 m-85 -118.54 161.0 20.75 Favored 'General case' 0 C--N 1.282 -2.341 0 N-CA-C 106.372 -1.714 . . . . 0.0 106.372 175.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.506 HG12 HG12 ' A' ' 471' ' ' VAL . 6.2 m -121.86 140.22 46.5 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.336 0 C-N-CA 120.896 -0.322 . . . . 0.0 110.501 179.031 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -96.07 132.96 40.9 Favored 'General case' 0 C--O 1.297 3.553 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.267 172.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 74.7 m80 -25.15 157.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 129.94 3.296 . . . . 0.0 117.385 -171.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 107.08 -2.43 35.34 Favored Glycine 0 CA--C 1.502 -0.764 0 N-CA-C 108.286 -1.926 . . . . 0.0 108.286 -172.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.537 ' HA ' ' CZ ' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -101.77 161.46 13.64 Favored 'General case' 0 N--CA 1.406 -2.648 0 CA-C-N 113.12 -1.54 . . . . 0.0 114.584 -174.822 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 178.81 94.01 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.353 0 N-CA-C 104.326 -2.472 . . . . 0.0 104.326 168.797 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -142.72 157.56 44.53 Favored 'General case' 0 C--N 1.303 -1.443 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.919 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 97.6 mttt -99.71 132.0 45.33 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 108.544 -0.91 . . . . 0.0 108.544 173.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.419 ' HA ' ' CD1' ' A' ' 444' ' ' TRP . 17.7 p -101.74 19.11 18.79 Favored 'General case' 0 C--N 1.307 -1.28 0 CA-C-O 121.235 0.54 . . . . 0.0 111.965 -177.564 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -75.8 -27.53 57.98 Favored 'General case' 0 C--N 1.313 -1.006 0 CA-C-O 121.511 0.672 . . . . 0.0 111.609 -177.422 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -94.57 8.43 42.28 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 122.33 1.062 . . . . 0.0 109.855 -179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . 0.419 ' CD1' ' HA ' ' A' ' 441' ' ' THR . 12.7 m0 -80.18 121.1 81.46 Favored Pre-proline 0 C--N 1.307 -1.259 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.468 177.055 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -57.98 149.47 70.46 Favored 'Trans proline' 0 N--CA 1.457 -0.629 0 C-N-CA 122.55 2.167 . . . . 0.0 110.194 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -74.15 -22.53 59.4 Favored 'General case' 0 N--CA 1.405 -2.701 0 C-N-CA 123.066 0.546 . . . . 0.0 110.229 -174.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 95.8 mttt -124.35 123.84 41.08 Favored 'General case' 0 N--CA 1.436 -1.139 0 CA-C-N 115.65 -0.705 . . . . 0.0 109.555 173.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 90.2 mt -106.29 146.94 29.75 Favored 'General case' 0 C--N 1.291 -1.949 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 176.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 51.4 mm -98.53 119.12 46.11 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.222 0 N-CA-C 109.347 -0.612 . . . . 0.0 109.347 -174.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.508 ' SD ' HD23 ' A' ' 513' ' ' LEU . 54.2 ttp -113.33 129.7 56.46 Favored 'General case' 0 C--N 1.291 -1.953 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.347 -178.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . 0.434 ' HA ' ' OE1' ' A' ' 451' ' ' GLN . 14.8 mm-40 -119.0 130.93 55.94 Favored 'General case' 0 C--N 1.299 -1.596 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 175.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.486 HD13 HG21 ' A' ' 489' ' ' ILE . 77.9 mt -84.54 123.71 30.6 Favored 'General case' 0 C--N 1.296 -1.724 0 CA-C-N 115.272 -0.877 . . . . 0.0 110.233 -176.489 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 30.9 pt -128.61 158.03 73.24 Favored Pre-proline 0 C--N 1.305 -1.355 0 CA-C-N 115.279 -0.873 . . . . 0.0 109.51 -176.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -63.57 130.15 27.28 Favored 'Trans proline' 0 CA--C 1.54 0.803 0 C-N-CA 121.865 1.71 . . . . 0.0 111.312 175.8 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . 0.493 ' O ' ' HB3' ' A' ' 458' ' ' LEU . 21.1 tm0? -62.3 -29.93 70.78 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 123.249 0.62 . . . . 0.0 111.667 -177.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 50.6 tp60 -60.27 -31.08 69.89 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 179.709 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.8 mt -79.29 -12.75 59.94 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.218 0.533 . . . . 0.0 111.096 -178.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 455' ' ' GLN . 4.2 tt -73.74 -22.18 59.96 Favored 'General case' 0 C--N 1.321 -0.656 0 C-N-CA 124.036 0.934 . . . . 0.0 110.938 -178.357 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 41.7 p -58.42 -19.72 38.64 Favored 'General case' 0 CA--C 1.555 1.139 0 N-CA-C 113.984 1.105 . . . . 0.0 113.984 -173.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 14.6 t -70.76 -21.14 62.55 Favored 'General case' 0 CA--C 1.545 0.755 0 CA-C-O 121.279 0.561 . . . . 0.0 110.905 179.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 86.4 mt -88.62 11.05 18.44 Favored 'General case' 0 C--N 1.31 -1.151 0 CA-C-N 116.242 -0.435 . . . . 0.0 112.127 -176.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.19 -58.43 5.08 Favored Glycine 0 CA--C 1.548 2.115 0 CA-C-O 119.38 -0.678 . . . . 0.0 114.469 178.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.27 -24.44 78.85 Favored 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.899 2.4 . . . . 0.0 112.693 179.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 52.0 tp -75.46 -46.44 32.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.223 -177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 41.3 m-85 -70.69 -14.77 62.58 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 97.8 mtt180 -71.95 -17.13 62.1 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-O 120.813 0.339 . . . . 0.0 111.054 177.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -126.78 76.83 1.67 Allowed 'General case' 0 C--N 1.31 -1.145 0 N-CA-C 108.97 -0.752 . . . . 0.0 108.97 175.567 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . 0.413 ' HA ' ' CE2' ' A' ' 528' ' ' TYR . 69.3 m -152.8 170.99 18.96 Favored 'General case' 0 N--CA 1.44 -0.974 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.926 -178.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.537 ' CZ ' ' HA ' ' A' ' 437' ' ' GLU . 6.5 ptp180 -111.69 144.04 41.61 Favored 'General case' 0 C--N 1.303 -1.454 0 C-N-CA 125.889 1.676 . . . . 0.0 109.039 178.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . . . . . . . . . 27.3 mmm -95.4 152.61 18.24 Favored 'General case' 0 CA--C 1.489 -1.38 0 C-N-CA 120.296 -0.562 . . . . 0.0 110.405 -167.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.509 HG22 ' O ' ' A' ' 524' ' ' GLY . 16.8 m -127.14 162.08 32.91 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.275 -179.159 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . 0.474 ' HB3' ' HB2' ' A' ' 432' ' ' TYR . 55.8 tp60 -133.51 119.95 20.19 Favored 'General case' 0 C--N 1.289 -2.056 0 N-CA-C 107.011 -1.477 . . . . 0.0 107.011 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.406 ' HE1' HG21 ' A' ' 471' ' ' VAL . 30.4 m-85 -115.36 126.44 54.43 Favored 'General case' 0 C--O 1.262 1.741 0 CA-C-O 121.594 0.711 . . . . 0.0 111.57 -178.212 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 52.6 t-80 -131.97 123.19 26.86 Favored 'General case' 0 C--N 1.294 -1.812 0 N-CA-C 106.52 -1.659 . . . . 0.0 106.52 174.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . 0.417 ' HA ' ' HA ' ' A' ' 429' ' ' CYS . 56.4 m-85 -82.98 154.4 24.51 Favored 'General case' 0 C--N 1.294 -1.82 0 C-N-CA 120.664 -0.414 . . . . 0.0 111.83 -177.53 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 63.1 p -71.72 136.3 47.15 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 116.2 -0.455 . . . . 0.0 109.787 178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -77.55 20.81 0.3 Allowed 'General case' 0 C--N 1.311 -1.069 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 -174.159 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -67.98 -50.36 56.15 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.758 0.313 . . . . 0.0 111.448 179.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -120.07 83.19 2.01 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-O 121.602 0.715 . . . . 0.0 109.916 -175.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 93.6 mt -67.51 -24.76 65.6 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 114.865 -1.062 . . . . 0.0 111.383 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.426 ' O ' ' HB3' ' A' ' 484' ' ' LYS . 29.3 mm-40 -71.09 -45.02 64.51 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 112.846 0.684 . . . . 0.0 112.846 179.059 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 49.9 m -63.87 -37.16 86.36 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 121.279 0.561 . . . . 0.0 109.527 176.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.517 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 85.2 mt -64.57 -36.8 85.4 Favored 'General case' 0 C--O 1.213 -0.866 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.991 177.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 481' ' ' GLU . 36.9 ttpt -54.44 -44.49 72.53 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.715 0.806 . . . . 0.0 110.649 -178.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -69.3 -43.52 70.13 Favored Glycine 0 N--CA 1.442 -0.939 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.092 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.3 tt -63.88 -42.48 97.49 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 122.897 0.479 . . . . 0.0 110.081 -178.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . 0.517 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -58.49 -40.41 82.69 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 122.689 0.396 . . . . 0.0 111.351 177.342 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 3.1 tmt_? -67.28 -37.68 83.83 Favored 'General case' 0 CA--C 1.541 0.599 0 CA-C-N 116.242 -0.435 . . . . 0.0 110.2 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.486 HG21 HD13 ' A' ' 452' ' ' LEU . 65.6 mt -68.24 -45.58 82.59 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.436 0 CA-C-O 121.213 0.53 . . . . 0.0 110.193 177.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 12.1 mmt -63.62 -37.31 86.84 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.529 179.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.31 -9.95 84.35 Favored Glycine 0 N--CA 1.444 -0.824 0 CA-C-N 115.834 -0.621 . . . . 0.0 112.344 178.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -92.53 8.52 38.49 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-O 121.774 0.797 . . . . 0.0 109.943 -178.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 91.61 29.66 11.74 Favored Glycine 0 C--O 1.245 0.804 0 C-N-CA 119.986 -1.102 . . . . 0.0 112.889 176.665 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -109.24 157.03 19.21 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 176.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -128.24 160.51 31.89 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -118.15 109.1 1.74 Allowed Glycine 0 N--CA 1.421 -2.319 0 C-N-CA 120.004 -1.094 . . . . 0.0 111.461 -179.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 19.6 p -82.39 120.55 25.58 Favored 'General case' 0 C--N 1.295 -1.793 0 N-CA-C 108.075 -1.083 . . . . 0.0 108.075 177.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 61.6 t -102.35 120.2 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.723 0 CA-C-O 121.489 0.661 . . . . 0.0 109.411 -177.149 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . 0.4 ' NE2' HG22 ' A' ' 534' ' ' VAL . 42.3 m80 -112.01 137.48 49.97 Favored 'General case' 0 N--CA 1.418 -2.044 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.783 178.569 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -98.95 114.81 65.83 Favored Pre-proline 0 C--N 1.28 -2.424 0 CA-C-N 114.288 -1.324 . . . . 0.0 107.535 -178.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_exo -58.3 107.57 0.34 Allowed 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.153 1.902 . . . . 0.0 108.593 175.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -77.28 115.19 16.85 Favored 'General case' 0 N--CA 1.427 -1.578 0 C-N-CA 119.249 -0.981 . . . . 0.0 111.003 -174.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 8.8 t -101.53 -22.71 14.44 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 114.145 -1.389 . . . . 0.0 107.62 175.264 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.38 152.24 60.63 Favored Pre-proline 0 N--CA 1.439 -0.979 0 CA-C-N 114.624 -1.171 . . . . 0.0 109.163 177.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -81.9 -13.0 10.65 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 122.381 2.054 . . . . 0.0 112.166 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 24.8 t -95.56 168.74 10.5 Favored 'General case' 0 N--CA 1.435 -1.21 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 -178.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . 0.492 ' HG3' HE21 ' A' ' 530' ' ' GLN . 2.7 mp0 -60.84 101.46 0.15 Allowed 'General case' 0 C--N 1.317 -0.837 0 C-N-CA 124.346 1.059 . . . . 0.0 113.08 -176.12 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 33.6 t -85.62 109.13 18.02 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 105.975 -1.861 . . . . 0.0 105.975 172.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.402 ' H ' ' NE ' ' A' ' 509' ' ' ARG . 0.1 OUTLIER -56.75 150.83 15.28 Favored 'General case' 0 C--O 1.222 -0.355 0 O-C-N 124.268 0.98 . . . . 0.0 110.389 -175.82 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.563 ' O ' HG13 ' A' ' 526' ' ' ILE . 12.5 m -118.33 159.03 19.02 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.734 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 -174.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 6.4 tt -135.35 147.11 48.99 Favored 'General case' 0 C--N 1.318 -0.79 0 C-N-CA 119.119 -1.032 . . . . 0.0 112.747 -167.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 53.2 tpp -106.42 124.62 49.88 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 175.993 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.651 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -104.17 127.31 51.76 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-O 121.536 0.684 . . . . 0.0 110.354 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 63.6 mt -130.72 148.68 52.54 Favored 'General case' 0 C--N 1.296 -1.752 0 CA-C-N 114.975 -1.011 . . . . 0.0 109.664 -179.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 62.5 t80 -102.37 129.13 48.75 Favored 'General case' 0 C--N 1.277 -2.548 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 176.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 44.7 t -104.92 110.7 23.18 Favored 'General case' 0 N--CA 1.414 -2.246 0 N-CA-C 107.783 -1.192 . . . . 0.0 107.783 175.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 11.7 t -69.73 -22.43 63.38 Favored 'General case' 0 N--CA 1.437 -1.109 0 CA-C-N 115.676 -0.693 . . . . 0.0 109.165 175.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -62.66 -43.38 98.96 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 115.749 -0.659 . . . . 0.0 109.945 179.222 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -103.02 -4.75 24.18 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.574 -0.739 . . . . 0.0 111.306 -179.055 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt 59.99 30.02 19.55 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 124.616 1.166 . . . . 0.0 111.492 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -140.96 168.71 15.96 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.933 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.948 -175.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.651 ' HB3' HD11 ' A' ' 513' ' ' LEU . 44.3 m-85 -96.41 139.26 32.78 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -179.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 2.8 ppp? -138.05 166.51 23.92 Favored 'General case' 0 C--N 1.291 -1.972 0 C-N-CA 123.689 0.796 . . . . 0.0 109.485 -178.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . 0.509 ' O ' HG22 ' A' ' 471' ' ' VAL . . . 178.86 167.29 36.25 Favored Glycine 0 N--CA 1.42 -2.369 0 C-N-CA 119.135 -1.507 . . . . 0.0 111.745 178.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.451 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 6.1 mp -114.94 140.66 48.83 Favored 'General case' 0 C--N 1.289 -2.05 0 N-CA-C 109.073 -0.714 . . . . 0.0 109.073 170.373 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.563 HG13 ' O ' ' A' ' 510' ' ' VAL . 6.7 tt -103.38 107.86 57.22 Favored Pre-proline 0 C--N 1.299 -1.599 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.568 175.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.557 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 32.5 Cg_exo -66.33 132.21 28.81 Favored 'Trans proline' 0 C--O 1.282 2.689 0 C-N-CA 123.315 2.677 . . . . 0.0 113.286 172.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . 0.43 ' HE1' ' CZ ' ' A' ' 469' ' ' ARG . 43.3 m-85 -72.26 -38.98 68.73 Favored 'General case' 0 CA--C 1.498 -1.03 0 CA-C-N 113.175 -1.83 . . . . 0.0 109.094 178.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -82.35 87.29 6.6 Favored 'General case' 0 N--CA 1.427 -1.601 0 CA-C-N 114.384 -1.28 . . . . 0.0 109.428 -174.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . 0.492 HE21 ' HG3' ' A' ' 507' ' ' GLU . 4.9 pp0? -66.61 -34.53 78.1 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.741 -179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.8 p -58.92 -46.45 87.91 Favored 'General case' 0 N--CA 1.434 -1.258 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.467 178.175 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.65 -34.76 52.98 Favored Glycine 0 N--CA 1.429 -1.774 0 CA-C-N 116.292 -0.413 . . . . 0.0 113.254 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.494 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 73.5 t80 -70.54 -47.64 59.39 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 117.295 0.548 . . . . 0.0 110.556 -179.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . 0.4 HG22 ' NE2' ' A' ' 499' ' ' HIS . 99.1 t -64.79 -37.82 81.15 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.041 -0.527 . . . . 0.0 110.002 -179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 43.7 t-20 -59.54 -48.17 82.7 Favored 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -66.71 -44.58 89.16 Favored Glycine 0 C--N 1.332 0.356 0 C-N-CA 121.283 -0.484 . . . . 0.0 112.197 -178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.42 ' O ' HG13 ' A' ' 541' ' ' ILE . 39.9 mm -68.27 -22.15 27.19 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.853 0 CA-C-N 115.619 -0.291 . . . . 0.0 111.326 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -60.58 -40.44 91.69 Favored 'General case' 0 C--O 1.237 0.444 0 O-C-N 122.12 -0.363 . . . . 0.0 110.657 178.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -63.81 -38.02 89.53 Favored 'General case' 0 CA--C 1.517 -0.297 0 CA-C-O 121.413 0.625 . . . . 0.0 109.732 176.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 58.2 t -64.94 -49.96 77.28 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.898 0 CA-C-N 115.206 -0.906 . . . . 0.0 109.854 178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.42 HG13 ' O ' ' A' ' 537' ' ' ILE . 81.8 mt -60.68 -45.96 96.66 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 C-N-CA 123.18 0.592 . . . . 0.0 111.676 -178.295 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 13.7 t -65.93 -38.49 88.79 Favored 'General case' 0 C--O 1.242 0.681 0 C-N-CA 120.062 -0.655 . . . . 0.0 110.262 -177.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -68.7 -41.4 79.19 Favored 'General case' 0 C--N 1.319 -0.747 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.246 176.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.85 -33.69 74.23 Favored 'General case' 0 CA--C 1.541 0.635 0 C-N-CA 122.92 0.488 . . . . 0.0 110.361 -178.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 15.9 mm-40 -65.84 -26.59 67.73 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 121.045 0.45 . . . . 0.0 111.862 175.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 26.7 t60 -83.83 -28.78 27.8 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 107.825 -1.176 . . . . 0.0 107.825 174.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 73.25 156.78 0.18 Allowed 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.712 2.005 . . . . 0.0 109.711 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . 0.44 ' HB2' ' CE1' ' A' ' 550' ' ' HIS . 3.4 p80 -149.51 102.48 3.19 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 114.422 1.267 . . . . 0.0 114.422 -175.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 30.1 m170 -96.68 -40.73 8.85 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 169.11 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . 0.44 ' CE1' ' HB2' ' A' ' 548' ' ' HIS . 40.0 m80 71.49 4.37 5.03 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.167 1.387 . . . . 0.0 112.339 -178.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 32.5 m80 . . . . . 0 C--N 1.309 -1.193 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 176.309 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . 0.435 ' N ' ' HG ' ' A' ' 396' ' ' SER . 15.8 tpt . . . . . 0 CA--C 1.54 0.59 0 N-CA-C 111.243 0.09 . . . . 0.0 111.243 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 14.5 m -67.57 -42.18 82.99 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-O 121.323 0.582 . . . . 0.0 110.93 179.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 7.5 p -133.09 102.88 5.28 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.993 0 CA-C-O 122.236 1.017 . . . . 0.0 109.212 177.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . 0.435 ' HG ' ' N ' ' A' ' 393' ' ' MET . 39.4 m -147.58 -159.37 1.02 Allowed 'General case' 0 C--N 1.293 -1.885 0 N-CA-C 107.788 -1.19 . . . . 0.0 107.788 -176.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 19.7 m120 68.38 -156.44 0.19 Allowed 'General case' 0 C--O 1.254 1.312 0 O-C-N 123.799 0.687 . . . . 0.0 109.764 179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.26 147.89 28.61 Favored 'General case' 0 N--CA 1.434 -1.231 0 CA-C-O 121.094 0.473 . . . . 0.0 111.345 179.078 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . . . . . . . . . 4.3 mp -101.98 137.66 39.97 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.063 -175.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 62.9 tp -68.25 115.45 7.72 Favored 'General case' 0 C--N 1.316 -0.863 0 N-CA-C 108.469 -0.937 . . . . 0.0 108.469 175.236 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.66 -54.59 2.47 Favored 'General case' 0 C--N 1.301 -1.539 0 N-CA-C 112.541 0.571 . . . . 0.0 112.541 -175.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.548 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 74.4 t90 -159.45 144.95 15.87 Favored 'General case' 0 N--CA 1.432 -1.367 0 C-N-CA 120.302 -0.559 . . . . 0.0 110.187 -171.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 45.7 m -130.0 120.89 25.49 Favored 'General case' 0 C--N 1.279 -2.495 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 174.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.548 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -156.48 -171.67 22.98 Favored Glycine 0 N--CA 1.438 -1.197 0 N-CA-C 110.979 -0.849 . . . . 0.0 110.979 -174.021 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -121.28 142.57 36.91 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-N 116.909 0.354 . . . . 0.0 110.148 -176.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.665 HD13 ' SG ' ' A' ' 429' ' ' CYS . 9.8 mp -112.76 139.06 48.7 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 177.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.442 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 65.5 mt-10 -115.02 152.43 32.46 Favored 'General case' 0 C--O 1.254 1.34 0 N-CA-C 113.251 0.834 . . . . 0.0 113.251 -175.141 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -144.15 164.04 31.84 Favored 'General case' 0 N--CA 1.43 -1.443 0 C-N-CA 125.972 1.709 . . . . 0.0 108.997 -178.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 13.0 pt20 -115.17 157.59 23.43 Favored 'General case' 0 C--N 1.308 -1.224 0 CA-C-N 118.494 0.588 . . . . 0.0 111.012 -177.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . 0.442 ' CD ' ' HE ' ' A' ' 425' ' ' ARG . 12.1 mm-40 -85.14 146.0 27.34 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.09 170.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 31.7 mmtp 44.48 82.22 0.24 Allowed Pre-proline 0 C--O 1.243 0.726 0 C-N-CA 126.216 1.806 . . . . 0.0 114.146 172.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -58.14 -45.73 29.8 Favored 'Trans proline' 0 C--O 1.241 0.664 0 C-N-CA 122.263 1.975 . . . . 0.0 110.48 176.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -137.23 100.51 9.48 Favored Pre-proline 0 N--CA 1.442 -0.855 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.254 177.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -75.26 148.1 33.86 Favored 'Trans proline' 0 N--CA 1.452 -0.935 0 C-N-CA 122.17 1.914 . . . . 0.0 111.501 179.27 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -79.32 -19.73 49.65 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-O 121.624 0.726 . . . . 0.0 109.121 176.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 18.4 m -87.23 164.11 16.51 Favored 'General case' 0 N--CA 1.431 -1.379 0 CA-C-N 115.094 -0.957 . . . . 0.0 109.187 177.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 30.9 m -78.19 -13.52 13.87 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.748 0 CA-C-O 121.6 0.714 . . . . 0.0 110.347 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 18.0 t70 -122.46 137.41 54.88 Favored 'General case' 0 C--N 1.306 -1.319 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 -178.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -75.92 -17.18 59.86 Favored 'General case' 0 C--N 1.316 -0.854 0 O-C-N 123.316 0.385 . . . . 0.0 111.918 -177.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 65.88 -69.17 0.11 Allowed 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.422 1.489 . . . . 0.0 112.899 179.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 1.1 p -133.81 84.49 2.13 Favored 'General case' 0 N--CA 1.42 -1.948 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -178.09 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -86.65 79.79 8.78 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 122.468 1.128 . . . . 0.0 109.194 174.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 83.9 mt -93.66 152.73 18.79 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.08 -1.418 . . . . 0.0 109.536 -177.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 8.1 m -89.68 131.79 35.49 Favored 'General case' 0 N--CA 1.413 -2.304 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.271 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . 0.442 ' HE ' ' CD ' ' A' ' 410' ' ' GLU . 40.0 mmt180 -100.68 145.29 28.62 Favored 'General case' 0 C--N 1.286 -2.168 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 174.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.442 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 57.5 p -144.48 159.76 42.22 Favored 'General case' 0 C--N 1.259 -3.357 0 C-N-CA 120.037 -0.665 . . . . 0.0 109.208 179.199 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . 0.425 HD21 HD23 ' A' ' 483' ' ' LEU . 22.6 tp -146.55 117.36 4.72 Favored Pre-proline 0 N--CA 1.412 -2.367 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -69.51 132.29 23.42 Favored 'Trans proline' 0 C--O 1.244 0.789 0 C-N-CA 122.61 2.207 . . . . 0.0 110.667 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . 0.665 ' SG ' HD13 ' A' ' 406' ' ' LEU . 0.0 OUTLIER -125.8 157.73 36.78 Favored 'General case' 0 C--N 1.297 -1.687 0 CA-C-N 115.838 -0.619 . . . . 0.0 110.011 -175.515 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 25.0 mt-30 -116.89 128.92 55.71 Favored 'General case' 0 C--N 1.291 -1.976 0 N-CA-C 104.795 -2.298 . . . . 0.0 104.795 170.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 28.5 t -120.33 122.98 69.63 Favored 'Isoleucine or valine' 0 C--O 1.265 1.899 0 CA-C-O 122.137 0.97 . . . . 0.0 110.218 -176.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -114.09 155.09 26.61 Favored 'General case' 0 C--N 1.281 -2.408 0 N-CA-C 106.418 -1.697 . . . . 0.0 106.418 177.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 471' ' ' VAL . 26.2 m -122.33 140.74 45.27 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.405 0 C-N-CA 119.739 -0.785 . . . . 0.0 111.264 -179.467 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.65 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 27.0 t-20 -95.2 132.24 40.37 Favored 'General case' 1 C--O 1.324 4.998 0 N-CA-C 108.285 -1.005 . . . . 0.0 108.285 173.337 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . . . . . . . . . 31.6 m80 -34.35 161.42 0.0 OUTLIER 'General case' 0 C--N 1.361 1.1 0 O-C-N 127.824 3.203 . . . . 0.0 116.66 -171.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 106.59 -3.01 36.61 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 108.954 -1.658 . . . . 0.0 108.954 -174.128 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.41 ' HB3' ' HB3' ' A' ' 469' ' ' ARG . 0.0 OUTLIER -99.65 161.9 13.34 Favored 'General case' 0 N--CA 1.429 -1.506 0 C-N-CA 124.601 1.16 . . . . 0.0 113.978 -174.699 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -165.25 95.66 0.67 Allowed 'General case' 0 C--N 1.299 -1.599 0 N-CA-C 105.799 -1.926 . . . . 0.0 105.799 165.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -140.81 141.49 34.73 Favored 'General case' 0 C--N 1.301 -1.543 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.071 178.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 53.6 mtpt -96.45 118.2 32.46 Favored 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 174.498 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.487 HG21 ' HB2' ' A' ' 402' ' ' TRP . 43.5 p -81.21 5.19 17.76 Favored 'General case' 0 C--N 1.306 -1.295 0 CA-C-O 121.784 0.802 . . . . 0.0 111.099 -178.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -59.04 -32.0 69.35 Favored 'General case' 0 C--N 1.325 -0.483 0 C-N-CA 124.907 1.283 . . . . 0.0 109.943 175.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -90.81 4.58 51.3 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.914 -0.585 . . . . 0.0 111.297 -178.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 18.4 m0 -92.78 126.25 52.43 Favored Pre-proline 0 C--N 1.308 -1.235 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.855 -178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -66.19 162.93 33.7 Favored 'Trans proline' 0 N--CA 1.457 -0.644 0 C-N-CA 122.303 2.002 . . . . 0.0 110.474 176.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 50.4 mt-30 -75.58 -26.31 57.8 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-O 120.836 0.35 . . . . 0.0 111.044 -177.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 88.8 mttt -113.98 130.95 56.49 Favored 'General case' 0 N--CA 1.434 -1.262 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.666 -179.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 39.4 mt -118.84 147.83 43.52 Favored 'General case' 0 C--N 1.301 -1.542 0 CA-C-N 115.766 -0.652 . . . . 0.0 110.206 176.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 58.3 mt -98.33 123.64 50.98 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 N-CA-C 108.486 -0.931 . . . . 0.0 108.486 -176.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 65.8 ttp -100.47 132.54 45.8 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 62.8 tt0 -124.25 115.91 21.81 Favored 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.459 HD13 HG21 ' A' ' 489' ' ' ILE . 89.2 mt -88.55 116.25 26.66 Favored 'General case' 0 C--N 1.311 -1.071 0 CA-C-O 121.328 0.585 . . . . 0.0 110.728 -177.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.0 pt -119.87 161.66 37.02 Favored Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 125.033 1.333 . . . . 0.0 108.52 -176.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -67.48 129.58 20.46 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 121.393 1.395 . . . . 0.0 111.008 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -62.58 -36.59 83.2 Favored 'General case' 0 C--N 1.321 -0.631 0 C-N-CA 123.789 0.836 . . . . 0.0 111.566 -174.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -66.35 -20.93 66.22 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 115.766 -0.652 . . . . 0.0 112.473 -175.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 86.7 mt -86.92 -3.92 59.13 Favored 'General case' 0 C--N 1.31 -1.118 0 O-C-N 122.144 -0.348 . . . . 0.0 111.507 -178.69 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 60.5 tp -82.06 -16.23 50.83 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.201 0.524 . . . . 0.0 110.99 -178.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 31.4 m -57.49 -25.68 60.15 Favored 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 124.068 0.947 . . . . 0.0 112.805 -177.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 16.7 p -70.55 -18.97 62.93 Favored 'General case' 0 CA--C 1.542 0.646 0 O-C-N 121.763 -0.586 . . . . 0.0 111.795 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 92.9 mt -99.75 10.54 41.16 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.654 -0.248 . . . . 0.0 111.299 -178.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -47.88 -54.98 10.43 Favored Glycine 0 CA--C 1.54 1.631 0 CA-C-O 119.399 -0.667 . . . . 0.0 114.038 179.448 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.98 -20.19 59.1 Favored 'Trans proline' 0 C--N 1.367 1.534 0 C-N-CA 122.759 2.306 . . . . 0.0 113.272 178.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 47.3 tp -78.81 -35.65 43.86 Favored 'General case' 0 C--N 1.316 -0.885 0 N-CA-C 109.706 -0.479 . . . . 0.0 109.706 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -69.39 -13.06 62.17 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.323 0.649 . . . . 0.0 112.379 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 87.1 mtt180 -57.57 -30.46 65.26 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 177.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 51.8 t-20 -127.02 97.12 4.83 Favored 'General case' 0 C--N 1.307 -1.28 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 176.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . 0.561 ' HB2' HD23 ' A' ' 525' ' ' LEU . 75.1 m -156.46 172.1 19.12 Favored 'General case' 0 C--N 1.296 -1.738 0 C-N-CA 123.66 0.784 . . . . 0.0 110.013 179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.41 ' HB3' ' HB3' ' A' ' 437' ' ' GLU . 48.8 mtm180 -109.42 142.06 40.94 Favored 'General case' 0 C--N 1.291 -1.977 0 N-CA-C 107.476 -1.305 . . . . 0.0 107.476 -175.176 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.65 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 71.0 mmm -96.37 142.43 28.5 Favored 'General case' 0 CA--C 1.492 -1.264 0 C-N-CA 119.033 -1.067 . . . . 0.0 109.19 -168.425 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.582 HG12 HG12 ' A' ' 433' ' ' VAL . 4.9 m -131.59 153.56 38.98 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.64 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -178.572 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -132.08 127.04 35.24 Favored 'General case' 0 C--N 1.288 -2.088 0 N-CA-C 108.497 -0.927 . . . . 0.0 108.497 178.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 24.3 m-85 -111.47 125.9 54.38 Favored 'General case' 0 C--O 1.266 1.928 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.347 -177.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 48.0 t-80 -130.04 127.77 40.6 Favored 'General case' 0 C--N 1.296 -1.719 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 172.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . 0.503 ' HB2' HD21 ' A' ' 483' ' ' LEU . 90.5 m-85 -99.22 166.04 11.41 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 -178.229 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . 0.407 ' OG1' ' HG2' ' A' ' 478' ' ' LYS . 8.8 t -84.2 149.09 26.37 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 177.126 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 28.3 p-10 -87.06 10.27 17.12 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 122.992 0.517 . . . . 0.0 111.342 -176.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.407 ' HG2' ' OG1' ' A' ' 476' ' ' THR . 74.8 mmtt -63.21 -38.22 90.32 Favored 'General case' 0 C--N 1.316 -0.864 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.899 -179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -119.37 88.0 2.85 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.984 -0.686 . . . . 0.0 109.631 -179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.408 HD23 HD12 ' A' ' 483' ' ' LEU . 63.4 mt -67.01 -23.99 65.97 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 115.698 -0.683 . . . . 0.0 112.329 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -61.11 -51.28 69.79 Favored 'General case' 0 C--O 1.24 0.599 0 O-C-N 123.027 0.205 . . . . 0.0 110.753 178.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . 0.418 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 30.2 m -64.06 -36.67 84.77 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 116.145 -0.479 . . . . 0.0 111.052 179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.503 HD21 ' HB2' ' A' ' 475' ' ' PHE . 79.0 mt -69.1 -48.89 61.43 Favored 'General case' 0 C--O 1.211 -0.935 0 N-CA-C 111.881 0.326 . . . . 0.0 111.881 178.602 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -54.66 -45.41 73.85 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.293 1.037 . . . . 0.0 111.101 -177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.464 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.83 -44.92 66.76 Favored Glycine 0 N--CA 1.439 -1.16 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.57 178.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -62.66 -43.66 98.24 Favored 'General case' 0 CA--C 1.546 0.809 0 N-CA-C 109.703 -0.481 . . . . 0.0 109.703 -177.191 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 3.5 m-30 -58.38 -42.48 87.16 Favored 'General case' 0 C--O 1.239 0.531 0 C-N-CA 123.244 0.618 . . . . 0.0 110.513 177.598 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 19.8 tpp180 -67.72 -44.62 77.2 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.96 -178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.464 HG13 ' O ' ' A' ' 485' ' ' GLY . 72.9 mt -64.44 -47.9 87.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.913 -179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . 0.45 ' HB3' ' HB3' ' A' ' 515' ' ' TYR . 17.5 mmt -63.09 -44.71 94.96 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 120.787 0.327 . . . . 0.0 111.086 -179.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -69.04 -15.09 69.14 Favored Glycine 0 CA--C 1.52 0.352 0 CA-C-N 115.932 -0.576 . . . . 0.0 112.606 -178.305 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 6.5 t30 -85.46 2.5 44.34 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 123.687 0.795 . . . . 0.0 109.712 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.36 30.92 6.36 Favored Glycine 0 N--CA 1.439 -1.114 0 C-N-CA 119.452 -1.356 . . . . 0.0 112.774 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -111.63 162.22 15.41 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 122.603 -0.351 . . . . 0.0 110.843 176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -133.73 158.84 42.28 Favored 'General case' 0 C--N 1.3 -1.585 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 179.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.48 107.17 1.32 Allowed Glycine 0 N--CA 1.422 -2.245 0 C-N-CA 119.968 -1.111 . . . . 0.0 112.074 -178.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 38.7 t -85.91 121.52 28.66 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 176.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . 0.415 ' HB ' ' HG ' ' A' ' 511' ' ' LEU . 73.2 t -102.21 120.57 52.1 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.061 0 CA-C-O 122.078 0.942 . . . . 0.0 109.896 -177.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . 0.44 ' NE2' HG22 ' A' ' 534' ' ' VAL . 29.9 m80 -110.09 143.22 40.46 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.591 -178.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 1.2 m-85 -99.03 141.73 23.39 Favored Pre-proline 0 C--N 1.266 -3.042 0 N-CA-C 107.811 -1.181 . . . . 0.0 107.811 -177.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -55.7 126.63 23.08 Favored 'Trans proline' 0 C--O 1.247 0.955 0 C-N-CA 121.85 1.7 . . . . 0.0 108.519 171.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . 0.432 ' NE2' ' HA ' ' A' ' 505' ' ' PRO . 10.3 t60 -76.5 116.29 17.05 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.269 0.557 . . . . 0.0 109.52 -173.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 9.9 t -134.9 -46.93 0.73 Allowed 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 115.002 -0.999 . . . . 0.0 108.389 178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.73 125.36 71.35 Favored Pre-proline 0 N--CA 1.443 -0.795 0 N-CA-C 107.075 -1.454 . . . . 0.0 107.075 171.494 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . 0.432 ' HA ' ' NE2' ' A' ' 502' ' ' HIS . 42.0 Cg_endo -68.92 -32.74 21.6 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 121.977 1.785 . . . . 0.0 113.975 -174.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 11.1 p -134.43 -13.36 2.33 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 112.785 0.661 . . . . 0.0 112.785 -177.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -91.95 10.05 30.5 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 112.686 0.624 . . . . 0.0 112.686 -175.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 7.2 p -102.92 143.59 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.417 -2.123 0 C-N-CA 118.78 -1.168 . . . . 0.0 108.654 177.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.58 ' HG3' ' O ' ' A' ' 528' ' ' TYR . 6.6 mpt_? -116.45 174.37 6.1 Favored 'General case' 0 C--N 1.281 -2.413 0 N-CA-C 106.352 -1.721 . . . . 0.0 106.352 -179.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.9 m -126.84 164.09 28.04 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.35 0 C-N-CA 118.687 -1.205 . . . . 0.0 108.266 179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.554 ' HB3' HG12 ' A' ' 526' ' ' ILE . 1.3 pp -137.74 151.02 47.76 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 117.111 -1.836 . . . . 0.0 111.92 -175.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . 0.501 ' O ' ' HA3' ' A' ' 524' ' ' GLY . 35.4 tpp -104.77 134.59 47.65 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 177.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.42 HD11 ' HB3' ' A' ' 522' ' ' PHE . 58.1 tp -119.39 120.34 36.61 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 123.399 0.68 . . . . 0.0 109.994 -179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 62.5 mt -129.03 146.12 51.08 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.612 -0.722 . . . . 0.0 109.301 178.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.45 ' HB3' ' HB3' ' A' ' 490' ' ' MET . 33.5 t80 -99.09 123.57 43.48 Favored 'General case' 0 C--N 1.282 -2.361 0 N-CA-C 109.306 -0.628 . . . . 0.0 109.306 178.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . 0.443 ' OG ' ' HD3' ' A' ' 519' ' ' LYS . 38.3 t -99.24 111.16 23.6 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 174.557 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 40.5 m -67.83 -29.25 68.36 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 114.486 -1.233 . . . . 0.0 111.416 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 30.0 mmmt -75.02 -40.41 60.52 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.322 0.582 . . . . 0.0 109.694 -176.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . 0.443 ' HD3' ' OG ' ' A' ' 516' ' ' SER . 3.8 mptp? -85.83 -9.91 56.26 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.22 178.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 47.4 tptt 63.5 24.28 14.0 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 125.206 1.402 . . . . 0.0 110.482 179.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -143.37 167.73 13.18 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.858 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.961 -173.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 30.9 m-85 -97.09 139.02 33.71 Favored 'General case' 0 N--CA 1.417 -2.123 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -179.013 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 56.4 ttp -138.94 148.66 43.83 Favored 'General case' 0 C--N 1.285 -2.216 0 N-CA-C 107.306 -1.368 . . . . 0.0 107.306 -178.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . 0.501 ' HA3' ' O ' ' A' ' 512' ' ' MET . . . -160.55 170.82 36.6 Favored Glycine 0 N--CA 1.421 -2.34 0 C-N-CA 119.29 -1.433 . . . . 0.0 111.589 179.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.561 HD23 ' HB2' ' A' ' 468' ' ' SER . 7.3 mp -115.59 139.98 49.6 Favored 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 171.634 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.554 HG12 ' HB3' ' A' ' 511' ' ' LEU . 0.0 OUTLIER -103.59 108.08 58.25 Favored Pre-proline 0 C--N 1.298 -1.667 0 C-N-CA 120.178 -0.609 . . . . 0.0 109.862 -179.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 37.5 Cg_exo -69.07 133.6 27.26 Favored 'Trans proline' 0 C--O 1.295 3.327 0 C-N-CA 123.852 3.035 . . . . 0.0 114.504 175.545 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . 0.58 ' O ' ' HG3' ' A' ' 509' ' ' ARG . 49.4 m-85 -65.68 -45.38 83.08 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 112.541 -2.118 . . . . 0.0 111.776 -176.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -99.51 119.09 37.47 Favored 'General case' 0 CA--C 1.491 -1.327 0 C-N-CA 119.719 -0.792 . . . . 0.0 111.844 -173.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -66.56 -41.86 87.98 Favored 'General case' 0 C--N 1.307 -1.269 0 CA-C-N 114.807 -1.088 . . . . 0.0 111.349 -179.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 44.3 t -65.91 -48.07 72.65 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 111.876 0.324 . . . . 0.0 111.876 -173.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -65.57 -43.6 94.25 Favored Glycine 0 N--CA 1.44 -1.07 0 C-N-CA 121.404 -0.427 . . . . 0.0 112.802 -177.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 41.1 t80 -71.15 -47.4 57.98 Favored 'General case' 0 N--CA 1.437 -1.076 0 C-N-CA 120.61 -0.436 . . . . 0.0 111.436 -177.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . 0.44 HG22 ' NE2' ' A' ' 499' ' ' HIS . 93.7 t -64.62 -38.98 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 CA-C-O 120.776 0.322 . . . . 0.0 110.601 -177.552 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -61.49 -36.78 81.46 Favored 'General case' 0 N--CA 1.47 0.567 0 CA-C-O 121.284 0.564 . . . . 0.0 110.172 178.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.93 -46.4 37.18 Favored Glycine 0 CA--C 1.527 0.835 0 CA-C-N 116.043 -0.526 . . . . 0.0 112.018 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 31.4 mm -64.25 -28.15 44.26 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 123.423 0.689 . . . . 0.0 111.521 179.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 77.5 ttt180 -55.55 -39.37 70.53 Favored 'General case' 0 C--N 1.32 -0.698 0 C-N-CA 122.887 0.475 . . . . 0.0 110.626 178.367 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -65.35 -40.98 94.32 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 109.719 -0.474 . . . . 0.0 109.719 177.58 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 43.1 t -63.4 -42.63 96.99 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.837 -0.619 . . . . 0.0 109.553 -179.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 88.9 mt -61.1 -46.31 96.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 38.9 m -61.59 -42.18 98.5 Favored 'General case' 0 N--CA 1.427 -1.592 0 CA-C-N 115.213 -0.903 . . . . 0.0 111.71 178.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -64.39 -43.41 94.52 Favored 'General case' 0 C--O 1.211 -0.932 0 N-CA-C 110.206 -0.294 . . . . 0.0 110.206 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 63.5 tp -56.5 -47.96 78.2 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.223 0.609 . . . . 0.0 110.537 177.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -62.76 -36.53 83.38 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.588 -0.733 . . . . 0.0 111.239 178.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -72.64 -33.8 66.87 Favored 'General case' 0 CA--C 1.512 -0.5 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 53.0 m170 -58.91 -48.47 81.32 Favored 'General case' 0 CA--C 1.501 -0.905 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 174.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 30.4 t-80 58.91 77.07 0.32 Allowed 'General case' 0 N--CA 1.45 -0.472 0 O-C-N 124.673 1.233 . . . . 0.0 109.069 177.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 43.5 m-70 -73.09 118.19 15.74 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-N 115.105 -0.952 . . . . 0.0 109.421 -176.462 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 4.4 p80 63.47 166.07 0.13 Allowed 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 126.921 2.088 . . . . 0.0 112.733 -177.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 47.9 t-80 . . . . . 0 C--N 1.294 -1.807 0 N-CA-C 105.575 -2.009 . . . . 0.0 105.575 171.81 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 25.7 ptt? . . . . . 0 CA--C 1.511 -0.54 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 15.8 p -75.7 156.94 34.25 Favored 'General case' 0 C--O 1.25 1.106 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 178.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 13.6 p -79.1 72.45 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.551 0.993 0 CA-C-O 123.054 1.407 . . . . 0.0 111.675 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 19.6 m -98.73 30.63 3.23 Favored 'General case' 0 C--N 1.304 -1.408 0 CA-C-N 114.499 -1.228 . . . . 0.0 108.475 178.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 52.7 t30 -97.08 137.1 36.66 Favored 'General case' 0 N--CA 1.433 -1.303 0 CA-C-N 114.438 -1.256 . . . . 0.0 109.73 -178.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -122.24 132.37 54.39 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-O 121.313 0.577 . . . . 0.0 110.29 172.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.545 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.0 mp -95.05 132.62 39.74 Favored 'General case' 0 C--N 1.294 -1.828 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.857 -172.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 2.0 tt -72.09 118.83 15.45 Favored 'General case' 0 C--N 1.315 -0.908 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 179.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.87 -52.72 2.77 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 -172.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.492 ' HB2' HG21 ' A' ' 441' ' ' THR . 65.2 t90 -154.57 149.89 27.15 Favored 'General case' 0 C--O 1.209 -1.066 0 C-N-CA 120.46 -0.496 . . . . 0.0 111.266 -171.722 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 22.8 t -131.81 130.05 41.28 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.461 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -162.33 -172.79 30.22 Favored Glycine 0 N--CA 1.435 -1.367 0 N-CA-C 110.772 -0.931 . . . . 0.0 110.772 -177.388 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.494 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 48.1 t -113.22 139.29 39.29 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 N-CA-C 109.611 -0.514 . . . . 0.0 109.611 -176.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.535 ' O ' ' HA ' ' A' ' 426' ' ' SER . 72.8 mt -113.92 140.96 47.95 Favored 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 108.645 -0.872 . . . . 0.0 108.645 177.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.64 ' HG2' ' HB3' ' A' ' 426' ' ' SER . 58.5 mt-10 -115.37 126.28 54.23 Favored 'General case' 0 C--N 1.295 -1.791 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 174.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 58.6 p-90 -123.03 130.87 53.35 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 113.845 1.054 . . . . 0.0 113.845 -173.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -128.49 145.87 50.98 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 114.528 -1.214 . . . . 0.0 111.21 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . 0.513 ' CB ' ' HB2' ' A' ' 452' ' ' LEU . 15.9 tt0 166.74 -69.71 0.0 OUTLIER 'General case' 0 CA--C 1.506 -0.737 0 C-N-CA 127.534 2.333 . . . . 0.0 106.002 171.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 50.3 mttp -119.27 88.88 38.7 Favored Pre-proline 0 N--CA 1.436 -1.126 0 CA-C-N 114.846 -1.07 . . . . 0.0 110.889 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -79.42 80.34 3.1 Favored 'Trans proline' 0 N--CA 1.429 -2.272 0 N-CA-C 106.157 -2.286 . . . . 0.0 106.157 168.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -72.69 142.95 84.18 Favored Pre-proline 0 N--CA 1.434 -1.231 0 CA-C-N 113.959 -1.473 . . . . 0.0 109.854 -173.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . 0.531 ' HA ' ' OD2' ' A' ' 418' ' ' ASP . 9.9 Cg_endo -53.01 120.56 7.87 Favored 'Trans proline' 0 C--O 1.255 1.328 0 C-N-CA 122.623 2.215 . . . . 0.0 110.321 173.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -99.8 -34.93 9.96 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-O 121.046 0.451 . . . . 0.0 110.574 -177.08 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 61.2 m -156.04 -74.62 0.1 Allowed 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.544 178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 46.7 t -133.02 85.14 0.72 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.31 0 CA-C-O 121.236 0.541 . . . . 0.0 110.256 -177.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . 0.531 ' OD2' ' HA ' ' A' ' 414' ' ' PRO . 12.5 p-10 -137.91 118.46 13.91 Favored 'General case' 0 C--N 1.293 -1.859 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.864 177.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.7 -33.83 17.4 Favored 'General case' 0 C--N 1.307 -1.242 0 CA-C-N 115.546 -0.752 . . . . 0.0 109.86 178.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -81.44 153.24 27.0 Favored 'General case' 0 C--N 1.316 -0.879 0 CA-C-N 115.397 -0.82 . . . . 0.0 109.476 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 23.7 m -103.82 -30.98 10.03 Favored 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 113.095 0.776 . . . . 0.0 113.095 -173.71 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 63.8 tttm -90.72 89.19 7.4 Favored 'General case' 0 C--N 1.283 -2.288 0 C-N-CA 119.082 -1.047 . . . . 0.0 112.075 -175.039 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.56 143.01 39.84 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-N 114.6 -1.182 . . . . 0.0 108.287 175.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 5.6 m -100.58 120.11 39.54 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.29 -1.745 . . . . 0.0 106.29 175.516 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . 0.41 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 16.2 mmm180 -103.56 145.11 30.52 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 178.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.64 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 33.8 p -141.86 138.44 32.13 Favored 'General case' 0 N--CA 1.414 -2.254 0 O-C-N 123.459 0.475 . . . . 0.0 110.495 -175.263 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 96.8 mt -137.25 118.15 10.78 Favored Pre-proline 0 C--N 1.293 -1.883 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.695 -179.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -65.27 138.62 56.55 Favored 'Trans proline' 0 C--O 1.249 1.056 0 C-N-CA 122.7 2.267 . . . . 0.0 109.542 170.178 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . 0.506 ' HB3' ' CD2' ' A' ' 475' ' ' PHE . 12.5 p -144.98 165.42 28.2 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-O 121.13 0.49 . . . . 0.0 111.692 -175.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 28.8 pt20 -116.45 133.25 56.23 Favored 'General case' 0 N--CA 1.424 -1.75 0 N-CA-C 106.596 -1.631 . . . . 0.0 106.596 174.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 29.9 t -121.45 124.16 71.22 Favored 'Isoleucine or valine' 0 C--O 1.259 1.564 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.459 -174.383 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 64.6 m-85 -105.25 160.81 14.81 Favored 'General case' 0 C--N 1.285 -2.203 0 N-CA-C 107.138 -1.43 . . . . 0.0 107.138 175.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 471' ' ' VAL . 15.5 m -121.97 140.57 45.5 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.744 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 175.581 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.538 ' HB3' ' CB ' ' A' ' 470' ' ' MET . 27.1 t-20 -96.16 132.18 41.85 Favored 'General case' 1 C--O 1.316 4.565 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 169.28 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.545 ' CD2' HD11 ' A' ' 399' ' ' LEU . 77.0 m-70 -33.0 160.17 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.365 0 O-C-N 128.305 3.503 . . . . 0.0 116.438 -170.372 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.74 -1.27 30.44 Favored Glycine 0 CA--C 1.497 -1.06 0 N-CA-C 109.473 -1.451 . . . . 0.0 109.473 -176.282 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -99.48 161.66 13.49 Favored 'General case' 0 C--N 1.289 -2.039 0 C-N-CA 126.194 1.798 . . . . 0.0 115.121 -172.313 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -159.36 98.88 1.44 Allowed 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 105.477 -2.046 . . . . 0.0 105.477 168.418 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . 0.403 HD12 ' CZ2' ' A' ' 444' ' ' TRP . 1.9 pt? -139.19 139.38 37.5 Favored 'General case' 0 C--N 1.305 -1.335 0 O-C-N 121.732 -0.605 . . . . 0.0 112.163 -175.506 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -103.07 106.6 17.15 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 169.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.492 HG21 ' HB2' ' A' ' 402' ' ' TRP . 25.2 p -80.28 -2.79 46.67 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 122.215 1.007 . . . . 0.0 112.435 -175.337 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -74.13 -14.22 60.94 Favored 'General case' 0 C--N 1.3 -1.558 0 CA-C-N 114.886 -1.052 . . . . 0.0 110.225 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 48.9 tp60 -101.45 9.61 41.25 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 108.362 -0.977 . . . . 0.0 108.362 177.782 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . 0.403 ' CZ2' HD12 ' A' ' 439' ' ' LEU . 33.7 m0 -99.08 140.64 21.85 Favored Pre-proline 0 C--O 1.247 0.945 0 CA-C-N 114.971 -1.013 . . . . 0.0 109.368 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_endo -70.64 153.99 64.54 Favored 'Trans proline' 0 N--CA 1.446 -1.272 0 C-N-CA 121.877 1.718 . . . . 0.0 109.816 173.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 13.1 pt20 -81.0 -5.16 57.25 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.248 0.833 . . . . 0.0 113.248 -175.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.494 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 92.3 mttt -132.21 126.21 33.0 Favored 'General case' 0 CA--C 1.499 -0.996 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.341 176.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . 0.411 HD22 ' HA ' ' A' ' 500' ' ' PHE . 73.5 mt -118.6 146.99 44.2 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 178.166 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 63.4 mt -105.02 125.97 59.99 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.107 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.501 -177.433 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.408 ' HB2' HG22 ' A' ' 498' ' ' VAL . 48.5 ttp -106.79 118.02 35.58 Favored 'General case' 0 N--CA 1.426 -1.664 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.426 179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 59.8 tp60 -99.86 127.04 46.06 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 175.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . 0.55 HD13 HG21 ' A' ' 489' ' ' ILE . 29.6 mt -86.67 136.79 32.9 Favored 'General case' 0 C--N 1.28 -2.413 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 -179.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 28.1 pt -138.31 161.27 60.14 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.83 129.09 16.92 Favored 'Trans proline' 0 N--CA 1.454 -0.84 0 C-N-CA 121.348 1.366 . . . . 0.0 111.234 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.5 tt0 -63.37 -25.13 68.15 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.916 0.886 . . . . 0.0 111.77 -177.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -58.76 -37.04 75.37 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 120.851 0.358 . . . . 0.0 110.976 177.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 7.7 mp -83.3 3.21 32.38 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 121.298 0.57 . . . . 0.0 111.42 -177.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 49.2 tp -72.95 -16.45 61.53 Favored 'General case' 0 C--O 1.246 0.897 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.882 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 18.8 p -58.74 -30.62 67.62 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.854 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 7.5 m -71.27 -18.81 62.41 Favored 'General case' 0 CA--C 1.557 1.213 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.538 -179.477 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -103.02 5.28 38.1 Favored 'General case' 0 CA--C 1.511 -0.557 0 O-C-N 122.106 -0.371 . . . . 0.0 111.806 -175.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.3 -55.44 3.04 Favored Glycine 0 CA--C 1.559 2.781 0 CA-C-N 114.854 -1.067 . . . . 0.0 115.304 179.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 16.7 Cg_endo -58.23 -26.43 76.5 Favored 'Trans proline' 0 C--N 1.368 1.588 0 C-N-CA 123.405 2.737 . . . . 0.0 114.011 179.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -69.77 -46.12 66.51 Favored 'General case' 0 CA--C 1.511 -0.541 0 N-CA-C 110.059 -0.348 . . . . 0.0 110.059 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -72.64 -14.72 61.66 Favored 'General case' 0 CA--C 1.506 -0.724 0 CA-C-N 115.531 -0.759 . . . . 0.0 111.215 -178.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 40.0 ttt180 -70.47 -24.77 62.92 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.357 178.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 44.0 m-80 -122.2 85.04 2.35 Favored 'General case' 0 C--N 1.312 -1.023 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 177.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . 0.439 ' HB2' HD23 ' A' ' 525' ' ' LEU . 53.2 m -151.73 163.04 40.01 Favored 'General case' 0 C--N 1.313 -1.008 0 CA-C-O 121.639 0.733 . . . . 0.0 112.657 -175.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 10.2 ptp180 -110.37 142.91 41.4 Favored 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 126.28 1.832 . . . . 0.0 106.458 177.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.538 ' CB ' ' HB3' ' A' ' 434' ' ' ASN . 1.9 mmm -96.66 151.33 19.73 Favored 'General case' 0 CA--C 1.487 -1.447 0 C-N-CA 118.439 -1.305 . . . . 0.0 110.976 -168.207 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.684 HG12 HG12 ' A' ' 433' ' ' VAL . 35.9 m -135.21 154.34 35.66 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.542 0 C-N-CA 123.695 0.798 . . . . 0.0 109.239 178.431 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.7 tt0 -134.14 123.64 24.74 Favored 'General case' 0 C--N 1.285 -2.215 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.455 ' CE2' HD11 ' A' ' 406' ' ' LEU . 25.6 m-85 -107.91 133.4 52.3 Favored 'General case' 0 C--O 1.278 2.564 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.901 -176.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -131.03 123.63 29.13 Favored 'General case' 0 N--CA 1.43 -1.425 0 N-CA-C 106.349 -1.723 . . . . 0.0 106.349 172.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . 0.506 ' CD2' ' HB3' ' A' ' 429' ' ' CYS . 98.4 m-85 -93.25 166.01 12.52 Favored 'General case' 0 C--N 1.305 -1.356 0 O-C-N 123.091 0.244 . . . . 0.0 110.545 -177.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 9.9 t -81.84 137.56 35.24 Favored 'General case' 0 N--CA 1.423 -1.783 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 173.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -87.25 37.17 0.76 Allowed 'General case' 0 C--N 1.299 -1.616 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.092 -176.002 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.8 ttmm -78.95 -52.93 7.59 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.096 0.474 . . . . 0.0 111.001 177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -103.9 78.22 1.52 Allowed 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 121.987 0.899 . . . . 0.0 108.65 -176.442 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 83.4 mt -62.84 -22.32 66.58 Favored 'General case' 0 C--N 1.31 -1.13 0 CA-C-N 114.321 -1.309 . . . . 0.0 113.478 -175.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 2.5 pm0 -69.52 -36.94 76.88 Favored 'General case' 0 C--N 1.31 -1.138 0 O-C-N 122.963 0.164 . . . . 0.0 111.248 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . 0.401 ' O ' ' HB2' ' A' ' 486' ' ' LEU . 66.6 m -67.42 -40.04 85.52 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 120.336 -0.546 . . . . 0.0 109.632 174.331 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.411 ' O ' ' HD1' ' A' ' 487' ' ' TYR . 3.7 mm? -63.76 -45.93 87.59 Favored 'General case' 0 C--O 1.206 -1.214 0 C-N-CA 120.546 -0.462 . . . . 0.0 110.739 176.62 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -55.21 -45.68 75.91 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 122.811 0.444 . . . . 0.0 110.611 -178.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.414 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -68.44 -44.23 74.38 Favored Glycine 0 N--CA 1.438 -1.231 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.033 178.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.401 ' HB2' ' O ' ' A' ' 482' ' ' SER . 1.1 tt -63.72 -43.81 95.45 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.438 0.695 . . . . 0.0 109.883 -177.715 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . 0.411 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 10.3 m-85 -56.91 -42.52 80.08 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 122.961 0.504 . . . . 0.0 111.053 177.281 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . 0.454 ' O ' ' HB2' ' A' ' 492' ' ' ASN . 55.5 mtp180 -67.26 -44.57 79.05 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.816 178.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.55 HG21 HD13 ' A' ' 452' ' ' LEU . 75.4 mt -61.04 -48.18 90.24 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 O-C-N 123.396 0.435 . . . . 0.0 110.688 -179.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 20.7 mmt -63.64 -46.63 84.78 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.465 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -68.5 -20.61 73.87 Favored Glycine 0 CA--C 1.53 1.03 0 C-N-CA 120.645 -0.788 . . . . 0.0 112.408 -179.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 488' ' ' ARG . 4.0 t30 -80.78 0.24 35.65 Favored 'General case' 0 C--O 1.245 0.866 0 CA-C-O 121.551 0.691 . . . . 0.0 110.197 -178.421 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.99 31.09 6.4 Favored Glycine 0 N--CA 1.439 -1.128 0 C-N-CA 119.998 -1.096 . . . . 0.0 113.384 177.592 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 79.8 m-85 -109.88 162.22 14.7 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 122.36 -0.494 . . . . 0.0 110.396 176.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -135.93 150.17 49.2 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -111.63 111.72 2.97 Favored Glycine 0 N--CA 1.43 -1.731 0 C-N-CA 119.482 -1.342 . . . . 0.0 113.031 -177.589 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . . . . . . . . . 12.3 p -85.06 115.55 22.94 Favored 'General case' 0 C--N 1.3 -1.561 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 176.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . 0.408 HG22 ' HB2' ' A' ' 450' ' ' MET . 47.6 t -101.48 120.85 51.65 Favored 'Isoleucine or valine' 0 C--O 1.258 1.523 0 CA-C-O 121.575 0.702 . . . . 0.0 109.535 -175.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 72.5 m80 -111.5 139.82 46.61 Favored 'General case' 0 N--CA 1.416 -2.147 0 CA-C-N 114.086 -1.416 . . . . 0.0 110.508 -177.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . 0.411 ' HA ' HD22 ' A' ' 448' ' ' LEU . 2.4 m-85 -102.21 133.43 20.62 Favored Pre-proline 0 C--N 1.292 -1.894 0 CA-C-N 113.915 -1.493 . . . . 0.0 108.761 -178.605 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_exo -57.92 141.75 96.16 Favored 'Trans proline' 0 C--O 1.255 1.345 0 N-CA-C 107.815 -1.648 . . . . 0.0 107.815 167.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 -75.38 116.44 16.11 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-O 121.934 0.873 . . . . 0.0 110.632 -171.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 19.0 m -130.08 -42.86 1.21 Allowed 'General case' 0 C--N 1.301 -1.526 0 CA-C-N 114.35 -1.296 . . . . 0.0 109.482 -177.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -85.11 118.9 71.81 Favored Pre-proline 0 C--O 1.24 0.587 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.72 175.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_exo -68.62 -28.92 30.78 Favored 'Trans proline' 0 N--CA 1.48 0.683 0 C-N-CA 122.93 2.42 . . . . 0.0 111.217 177.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 48.6 t -83.32 36.36 0.52 Allowed 'General case' 0 C--O 1.25 1.099 0 C-N-CA 123.605 0.762 . . . . 0.0 109.311 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 67.58 110.9 0.04 OUTLIER 'General case' 0 C--O 1.24 0.56 0 C-N-CA 125.235 1.414 . . . . 0.0 111.841 -178.701 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 13.9 p -70.62 -27.48 31.15 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.255 -179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 31.8 mtt180 73.42 169.07 0.31 Allowed 'General case' 0 C--N 1.359 0.986 0 C-N-CA 125.249 1.42 . . . . 0.0 109.614 175.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.544 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 16.0 m -131.1 163.91 35.67 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.84 0 C-N-CA 118.697 -1.201 . . . . 0.0 108.903 -174.411 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.505 ' HB3' HG12 ' A' ' 526' ' ' ILE . 3.3 pp -138.33 154.96 48.98 Favored 'General case' 0 CA--C 1.501 -0.919 0 C-N-CA 118.068 -1.453 . . . . 0.0 110.541 -179.681 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 41.3 ttm -117.25 130.1 56.34 Favored 'General case' 0 C--N 1.295 -1.772 0 C-N-CA 119.005 -1.078 . . . . 0.0 110.534 173.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.622 HD11 ' HB3' ' A' ' 522' ' ' PHE . 34.9 tp -95.63 129.78 42.72 Favored 'General case' 0 N--CA 1.411 -2.404 0 O-C-N 124.018 0.824 . . . . 0.0 108.991 -179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 64.4 mt -133.02 148.84 52.23 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.621 -1.172 . . . . 0.0 108.326 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -100.05 121.9 42.09 Favored 'General case' 0 C--N 1.271 -2.822 0 O-C-N 122.233 -0.292 . . . . 0.0 110.477 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 37.9 t -95.23 109.43 21.54 Favored 'General case' 0 N--CA 1.417 -2.104 0 N-CA-C 106.272 -1.751 . . . . 0.0 106.272 174.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 3.0 m -68.81 -35.41 76.96 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.472 -1.24 . . . . 0.0 110.733 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -69.6 -31.34 69.42 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.742 -0.663 . . . . 0.0 112.276 -177.598 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 99.9 mttt -97.59 -9.99 25.97 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-O 120.842 0.353 . . . . 0.0 110.4 178.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt 59.57 35.89 22.68 Favored 'General case' 0 C--O 1.245 0.853 0 C-N-CA 124.35 1.06 . . . . 0.0 111.413 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.5 pp -143.01 167.5 14.07 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.011 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -177.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.622 ' HB3' HD11 ' A' ' 513' ' ' LEU . 52.5 m-85 -98.83 138.57 35.78 Favored 'General case' 0 N--CA 1.413 -2.305 0 C-N-CA 119.407 -0.917 . . . . 0.0 108.901 179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.4 ptm -127.06 165.88 18.65 Favored 'General case' 0 C--N 1.284 -2.274 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -176.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.19 150.88 15.34 Favored Glycine 0 N--CA 1.41 -3.047 0 C-N-CA 119.054 -1.546 . . . . 0.0 112.055 177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.479 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 7.8 mp -114.29 140.24 48.76 Favored 'General case' 0 C--N 1.273 -2.743 0 N-CA-C 108.877 -0.786 . . . . 0.0 108.877 173.936 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.505 HG12 ' HB3' ' A' ' 511' ' ' LEU . 7.3 mt -99.24 108.05 47.89 Favored Pre-proline 0 N--CA 1.43 -1.429 0 O-C-N 123.793 0.683 . . . . 0.0 110.812 179.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.544 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 34.2 Cg_exo -68.69 131.2 22.23 Favored 'Trans proline' 0 C--O 1.295 3.348 0 C-N-CA 122.102 1.868 . . . . 0.0 110.963 168.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -74.63 -41.57 60.14 Favored 'General case' 0 N--CA 1.436 -1.169 0 CA-C-N 113.389 -1.732 . . . . 0.0 110.27 179.333 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -73.85 84.89 1.7 Allowed 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.906 -0.588 . . . . 0.0 109.995 179.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -66.37 -43.79 84.98 Favored 'General case' 0 N--CA 1.442 -0.861 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.127 -179.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 15.2 m -61.34 -44.0 97.92 Favored 'General case' 0 N--CA 1.439 -1.011 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.31 -179.107 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -68.56 -44.86 70.09 Favored Glycine 0 C--O 1.243 0.713 0 C-N-CA 121.171 -0.537 . . . . 0.0 112.866 -179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.495 ' CE2' HG13 ' A' ' 537' ' ' ILE . 67.6 t80 -67.4 -48.27 67.85 Favored 'General case' 0 C--N 1.325 -0.461 0 C-N-CA 122.126 0.17 . . . . 0.0 111.117 -178.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 86.3 t -63.2 -37.94 80.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 O-C-N 123.187 0.304 . . . . 0.0 110.567 -178.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -58.2 -46.91 84.99 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.039 0.447 . . . . 0.0 110.383 178.556 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -71.95 -43.38 49.65 Favored Glycine 0 N--CA 1.442 -0.927 0 CA-C-N 115.491 -0.777 . . . . 0.0 111.706 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.55 ' O ' HG12 ' A' ' 541' ' ' ILE . 32.8 mm -62.03 -36.24 73.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 122.383 0.273 . . . . 0.0 111.56 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -60.65 -35.4 76.1 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-O 121.202 0.525 . . . . 0.0 110.672 178.345 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 -70.07 -37.71 75.55 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 108.66 -0.867 . . . . 0.0 108.66 177.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 61.6 t -65.31 -37.94 81.36 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.808 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.642 175.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.55 HG12 ' O ' ' A' ' 537' ' ' ILE . 43.8 mm -60.39 -45.68 96.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 176.054 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 92.4 m -59.68 -42.93 94.03 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 114.699 -1.137 . . . . 0.0 110.658 178.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 94.3 m-20 -67.43 -37.29 82.81 Favored 'General case' 0 C--O 1.203 -1.39 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.558 177.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' A' ' 541' ' ' ILE . 51.9 tp -61.59 -44.93 96.11 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 124.197 0.999 . . . . 0.0 111.372 178.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . 0.528 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 46.7 mt-10 -65.39 -38.81 91.1 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.99 -178.801 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -83.09 -40.95 19.17 Favored 'General case' 0 C--N 1.304 -1.39 0 CA-C-N 115.61 -0.723 . . . . 0.0 111.251 -177.138 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 50.5 m80 -117.86 105.17 11.66 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-O 121.0 0.429 . . . . 0.0 111.354 -178.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 29.4 t-80 -95.29 44.47 1.09 Allowed 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 107.038 -1.467 . . . . 0.0 107.038 175.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 63.8 m-70 -121.61 132.2 54.54 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 113.441 0.904 . . . . 0.0 113.441 -174.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 18.1 p80 -123.17 11.01 9.41 Favored 'General case' 0 C--N 1.292 -1.904 0 N-CA-C 106.065 -1.828 . . . . 0.0 106.065 170.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 48.4 t-80 . . . . . 0 N--CA 1.424 -1.773 0 CA-C-N 112.46 -2.154 . . . . 0.0 105.591 -179.952 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 90.2 mtp . . . . . 0 CA--C 1.495 -1.137 0 N-CA-C 108.512 -0.921 . . . . 0.0 108.512 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 17.0 t 63.48 41.12 7.71 Favored 'General case' 0 CA--C 1.553 1.064 0 O-C-N 124.032 0.833 . . . . 0.0 110.321 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 9.6 p -71.75 -14.4 17.52 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.92 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.135 -177.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 15.0 m -86.59 -29.28 22.72 Favored 'General case' 0 N--CA 1.441 -0.913 0 O-C-N 121.506 -0.746 . . . . 0.0 109.644 178.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -76.8 -44.18 33.66 Favored 'General case' 0 CA--C 1.501 -0.931 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.222 175.267 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . 0.426 ' O ' ' HD2' ' A' ' 398' ' ' LYS . 0.0 OUTLIER -149.96 135.18 18.05 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.507 0.67 . . . . 0.0 112.375 -179.338 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.475 HD11 ' ND1' ' A' ' 435' ' ' HIS . 3.2 mp -115.25 137.47 52.0 Favored 'General case' 0 C--N 1.298 -1.662 0 N-CA-C 105.527 -2.027 . . . . 0.0 105.527 171.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -69.46 121.7 17.51 Favored 'General case' 0 C--N 1.313 -1.009 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -107.39 -57.08 2.13 Favored 'General case' 0 C--N 1.305 -1.336 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 -175.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.503 ' HB2' HG21 ' A' ' 441' ' ' THR . 61.2 t90 -153.37 145.36 23.66 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 120.895 0.379 . . . . 0.0 111.188 -173.296 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 25.0 p -119.72 126.91 52.22 Favored 'General case' 0 C--N 1.296 -1.736 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 174.313 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.45 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -165.47 -172.23 32.64 Favored Glycine 0 N--CA 1.433 -1.509 0 C-N-CA 119.955 -1.117 . . . . 0.0 112.328 -176.351 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.489 ' O ' ' HA ' ' A' ' 447' ' ' LYS . 59.5 t -113.19 135.54 52.37 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.009 0 N-CA-C 106.977 -1.49 . . . . 0.0 106.977 -177.474 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.428 ' CD1' ' HB2' ' A' ' 448' ' ' LEU . 15.7 tp -113.94 136.81 52.48 Favored 'General case' 0 C--N 1.283 -2.299 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 -178.615 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.481 ' HG2' ' CB ' ' A' ' 426' ' ' SER . 51.6 mt-10 -114.54 133.87 55.46 Favored 'General case' 0 N--CA 1.425 -1.716 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 -178.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 51.1 p-90 -127.39 142.08 51.52 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -176.352 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . 0.489 ' HB2' ' OE1' ' A' ' 451' ' ' GLN . 21.2 mt-30 -140.05 152.67 46.39 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.188 -179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -97.9 -56.71 2.42 Favored 'General case' 0 N--CA 1.438 -1.045 0 C-N-CA 120.749 -0.38 . . . . 0.0 111.522 174.774 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? 42.68 83.73 0.2 Allowed Pre-proline 0 N--CA 1.478 0.942 0 N-CA-C 114.847 1.425 . . . . 0.0 114.847 176.097 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -68.7 -39.73 8.39 Favored 'Trans proline' 0 C--O 1.238 0.501 0 C-N-CA 121.574 1.516 . . . . 0.0 110.456 177.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -104.01 139.92 20.57 Favored Pre-proline 0 N--CA 1.437 -1.082 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.78 -178.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 2.3 Cg_endo -43.86 -59.46 1.06 Allowed 'Trans proline' 0 C--N 1.361 1.233 0 C-N-CA 124.624 3.549 . . . . 0.0 114.582 -175.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -101.27 -25.6 13.93 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 120.436 -0.506 . . . . 0.0 110.058 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.6 m 68.05 -82.14 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.469 1.108 . . . . 0.0 108.752 -175.053 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 96.4 t -145.56 -68.28 0.08 OUTLIER 'Isoleucine or valine' 0 C--O 1.243 0.759 0 N-CA-C 107.44 -1.319 . . . . 0.0 107.44 173.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -136.55 137.81 40.63 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.378 -0.828 . . . . 0.0 109.419 -178.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.08 78.02 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.49 0.552 . . . . 0.0 112.49 -176.444 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -83.13 -15.4 50.86 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-O 121.225 0.535 . . . . 0.0 110.562 -174.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 26.9 m -75.03 -26.17 59.27 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.918 0.866 . . . . 0.0 109.818 177.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 46.7 mttm -98.71 91.78 5.27 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.177 173.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 92.0 mt -73.07 116.8 14.03 Favored 'General case' 0 N--CA 1.427 -1.605 0 CA-C-N 115.694 -0.685 . . . . 0.0 109.843 179.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . 0.481 HG23 ' HG3' ' A' ' 409' ' ' GLN . 19.9 m -63.49 137.63 58.21 Favored 'General case' 0 N--CA 1.409 -2.496 0 CA-C-N 114.448 -1.251 . . . . 0.0 108.514 177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 42.4 mmt180 -90.1 144.15 26.14 Favored 'General case' 0 N--CA 1.411 -2.405 0 N-CA-C 107.284 -1.376 . . . . 0.0 107.284 176.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.481 ' CB ' ' HG2' ' A' ' 407' ' ' GLU . 1.0 OUTLIER -137.85 130.14 29.17 Favored 'General case' 0 C--N 1.289 -2.043 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 -177.315 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 90.3 mt -131.47 126.73 21.34 Favored Pre-proline 0 C--N 1.294 -1.809 0 N-CA-C 109.945 -0.391 . . . . 0.0 109.945 -177.23 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -60.23 138.71 83.06 Favored 'Trans proline' 0 C--O 1.249 1.03 0 C-N-CA 122.286 1.991 . . . . 0.0 110.742 172.358 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 15.6 p -145.95 157.4 43.89 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 115.958 -0.565 . . . . 0.0 110.038 -177.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 27.0 pt20 -117.36 129.37 55.83 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 107.523 -1.288 . . . . 0.0 107.523 176.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 46.5 t -113.67 124.2 70.08 Favored 'Isoleucine or valine' 0 C--O 1.257 1.469 0 CA-C-O 121.732 0.777 . . . . 0.0 111.129 -173.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.8 m-85 -108.54 161.34 15.15 Favored 'General case' 0 C--N 1.28 -2.415 0 CA-C-N 114.193 -1.367 . . . . 0.0 107.321 176.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 471' ' ' VAL . 6.1 m -119.79 140.71 42.92 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.163 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 174.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.633 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 26.8 t-20 -94.06 130.13 40.32 Favored 'General case' 1 C--O 1.339 5.809 0 N-CA-C 105.98 -1.859 . . . . 0.0 105.98 171.713 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.475 ' ND1' HD11 ' A' ' 399' ' ' LEU . 0.5 OUTLIER -47.53 165.05 0.03 OUTLIER 'General case' 0 C--N 1.357 0.893 0 O-C-N 128.931 3.894 . . . . 0.0 115.372 -162.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . 0.449 ' H ' ' CD2' ' A' ' 435' ' ' HIS . . . 110.14 -2.98 29.88 Favored Glycine 0 N--CA 1.423 -2.168 0 N-CA-C 108.855 -1.698 . . . . 0.0 108.855 -172.146 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.455 ' OE1' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -132.38 159.59 38.79 Favored 'General case' 0 N--CA 1.425 -1.711 0 CA-C-N 115.314 -0.443 . . . . 0.0 110.558 -174.403 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -152.57 98.67 2.39 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 106.962 -1.495 . . . . 0.0 106.962 170.728 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . 0.542 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 0.6 OUTLIER -118.82 158.53 25.45 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 120.947 0.403 . . . . 0.0 111.91 -177.846 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -102.14 118.13 36.24 Favored 'General case' 0 N--CA 1.434 -1.23 0 N-CA-C 109.649 -0.501 . . . . 0.0 109.649 171.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.503 HG21 ' HB2' ' A' ' 402' ' ' TRP . 20.2 p -95.97 8.0 44.85 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-O 122.346 1.069 . . . . 0.0 109.626 179.629 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -65.81 -22.84 66.59 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.205 -1.362 . . . . 0.0 111.412 -178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 27.4 mm-40 -107.47 17.27 22.95 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.036 0.446 . . . . 0.0 111.532 177.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 20.1 m0 -91.17 136.03 27.7 Favored Pre-proline 0 C--N 1.307 -1.262 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.433 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_exo -64.43 158.75 47.65 Favored 'Trans proline' 0 N--CA 1.457 -0.662 0 C-N-CA 122.156 1.904 . . . . 0.0 109.469 174.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 -83.02 -7.09 59.7 Favored 'General case' 0 C--N 1.311 -1.066 0 C-N-CA 120.335 -0.546 . . . . 0.0 111.123 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.489 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 88.8 mttt -128.5 130.38 47.41 Favored 'General case' 0 C--N 1.317 -0.818 0 C-N-CA 122.756 0.422 . . . . 0.0 110.59 176.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . 0.428 ' HB2' ' CD1' ' A' ' 406' ' ' LEU . 83.8 mt -119.16 147.27 44.38 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 175.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 43.9 mm -99.22 120.54 48.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 110.39 -0.226 . . . . 0.0 110.39 -173.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.462 ' SD ' HD23 ' A' ' 513' ' ' LEU . 56.2 ttp -111.96 119.28 37.96 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 121.067 0.46 . . . . 0.0 111.333 178.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . 0.489 ' OE1' ' HB2' ' A' ' 409' ' ' GLN . 14.7 mm100 -104.9 133.16 50.17 Favored 'General case' 0 C--N 1.305 -1.334 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 176.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 84.3 mt -86.02 122.09 29.56 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 120.969 0.414 . . . . 0.0 111.0 -177.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 pt -129.77 157.81 75.58 Favored Pre-proline 0 C--N 1.313 -0.984 0 CA-C-N 115.754 -0.657 . . . . 0.0 109.676 -177.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -60.41 129.34 29.3 Favored 'Trans proline' 0 CA--C 1.545 1.074 0 C-N-CA 121.832 1.688 . . . . 0.0 113.134 177.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 -63.74 -25.46 68.21 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.197 0.999 . . . . 0.0 111.57 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -57.62 -41.49 81.41 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 123.584 0.753 . . . . 0.0 111.742 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 80.8 mt -83.04 5.58 21.8 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.902 -0.59 . . . . 0.0 112.133 -172.259 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.5 tt -80.97 -27.21 36.09 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.599 -178.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.8 m -58.08 -31.43 67.08 Favored 'General case' 0 CA--C 1.561 1.38 0 N-CA-C 112.845 0.683 . . . . 0.0 112.845 -174.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.7 m -72.46 -17.85 61.73 Favored 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 123.364 0.666 . . . . 0.0 112.439 -179.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 10.8 tp -85.6 11.12 11.41 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.304 0.642 . . . . 0.0 111.318 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -37.6 -54.54 1.77 Allowed Glycine 0 CA--C 1.545 1.966 0 N-CA-C 116.667 1.427 . . . . 0.0 116.667 -177.21 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -50.21 -40.67 51.54 Favored 'Trans proline' 0 C--N 1.372 1.791 0 C-N-CA 123.07 2.513 . . . . 0.0 113.424 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.76 -30.45 70.67 Favored 'General case' 0 N--CA 1.473 0.716 0 CA-C-O 121.201 0.524 . . . . 0.0 111.355 -178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 66.6 m-85 -78.07 -13.11 59.99 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.64 -0.709 . . . . 0.0 112.444 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.9 mmt180 -74.78 -43.33 55.38 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.963 -0.562 . . . . 0.0 109.621 175.81 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . 0.401 ' O ' ' HA ' ' A' ' 527' ' ' PRO . 9.8 p-10 -95.54 74.2 3.24 Favored 'General case' 0 C--N 1.311 -1.073 0 CA-C-O 122.025 0.917 . . . . 0.0 110.057 177.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 66.6 m -142.32 169.85 16.81 Favored 'General case' 0 N--CA 1.428 -1.557 0 CA-C-N 114.601 -1.181 . . . . 0.0 111.95 -176.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.542 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 14.3 ptp180 -139.63 143.79 37.37 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 127.529 2.332 . . . . 0.0 105.724 -179.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.633 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 62.1 mtp -97.23 153.12 18.22 Favored 'General case' 0 CA--C 1.483 -1.599 0 C-N-CA 115.982 -2.287 . . . . 0.0 111.875 -167.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.675 HG12 HG12 ' A' ' 433' ' ' VAL . 34.8 m -133.03 159.76 42.98 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.51 0 CA-C-N 115.459 -0.791 . . . . 0.0 109.993 179.159 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -134.28 121.39 21.21 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 177.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 14.1 m-85 -107.3 117.65 34.65 Favored 'General case' 0 C--N 1.291 -1.941 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.198 -177.27 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -111.87 122.27 47.33 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 106.641 -1.614 . . . . 0.0 106.641 174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 3.0 m-30 -93.81 160.57 14.69 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 116.519 -0.31 . . . . 0.0 110.532 -176.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . 0.472 ' O ' HD11 ' A' ' 483' ' ' LEU . 10.1 t -66.35 138.29 57.5 Favored 'General case' 0 N--CA 1.429 -1.512 0 O-C-N 123.73 0.644 . . . . 0.0 109.532 176.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 17.8 m120 -98.6 26.86 5.22 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 179.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 15.3 tppt? -60.25 -52.03 67.05 Favored 'General case' 0 N--CA 1.449 -0.525 0 CA-C-N 115.138 -0.937 . . . . 0.0 109.188 178.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -128.23 104.18 7.6 Favored 'General case' 0 C--N 1.314 -0.97 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.548 179.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 90.2 mt -66.96 -23.0 65.91 Favored 'General case' 0 C--N 1.311 -1.091 0 CA-C-N 115.569 -0.741 . . . . 0.0 112.346 -178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -69.91 -41.5 74.58 Favored 'General case' 0 C--O 1.247 0.933 0 CA-C-O 120.809 0.337 . . . . 0.0 111.211 -179.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 35.7 m -63.67 -35.31 80.12 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.958 -0.565 . . . . 0.0 109.749 175.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.472 HD11 ' O ' ' A' ' 476' ' ' THR . 93.5 mt -73.03 -51.41 18.26 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.04 178.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -55.33 -36.77 66.6 Favored 'General case' 0 C--N 1.328 -0.342 0 C-N-CA 123.193 0.597 . . . . 0.0 111.628 -175.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.492 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -60.51 -50.83 63.26 Favored Glycine 0 N--CA 1.446 -0.676 0 N-CA-C 111.043 -0.823 . . . . 0.0 111.043 176.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 60.1 tp -66.02 -42.8 89.15 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 123.251 0.62 . . . . 0.0 110.772 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -58.26 -45.51 87.69 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.18 0.592 . . . . 0.0 110.295 178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 8.2 ttp180 -65.41 -38.57 90.35 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.391 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 485' ' ' GLY . 80.4 mt -68.21 -50.38 58.44 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.494 0 CA-C-O 120.988 0.423 . . . . 0.0 110.572 178.605 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . 0.488 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 91.8 mtp -70.72 -35.79 72.89 Favored 'General case' 0 C--N 1.312 -1.039 0 O-C-N 122.134 -0.354 . . . . 0.0 111.592 -176.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.76 -18.66 70.56 Favored Glycine 0 CA--C 1.527 0.782 0 N-CA-C 111.549 -0.62 . . . . 0.0 111.549 176.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -81.92 6.84 14.61 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-O 121.869 0.842 . . . . 0.0 110.107 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.35 29.73 6.94 Favored Glycine 0 N--CA 1.444 -0.776 0 C-N-CA 120.529 -0.843 . . . . 0.0 113.015 178.508 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -112.45 158.67 19.58 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 175.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -129.28 160.14 33.92 Favored 'General case' 0 C--N 1.287 -2.14 0 N-CA-C 108.091 -1.078 . . . . 0.0 108.091 179.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -115.1 115.81 3.55 Favored Glycine 0 N--CA 1.417 -2.599 0 N-CA-C 110.812 -0.915 . . . . 0.0 110.812 -179.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . 0.41 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.6 t -92.74 118.89 31.55 Favored 'General case' 0 C--N 1.286 -2.162 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 179.312 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . 0.446 HG22 ' HB2' ' A' ' 450' ' ' MET . 78.0 t -101.66 120.78 51.75 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.564 0 CA-C-O 121.361 0.6 . . . . 0.0 110.151 -178.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . 0.505 ' NE2' HG22 ' A' ' 534' ' ' VAL . 27.1 m80 -109.36 140.46 43.02 Favored 'General case' 0 N--CA 1.423 -1.81 0 CA-C-N 114.42 -1.264 . . . . 0.0 109.41 177.055 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -104.06 125.89 33.21 Favored Pre-proline 0 C--N 1.292 -1.934 0 CA-C-N 114.788 -1.096 . . . . 0.0 109.535 -175.339 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -65.29 107.06 0.91 Allowed 'Trans proline' 0 N--CA 1.459 -0.501 0 C-N-CA 121.902 1.735 . . . . 0.0 108.351 172.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 26.2 p80 -91.23 117.47 29.66 Favored 'General case' 0 C--N 1.305 -1.344 0 N-CA-C 113.057 0.762 . . . . 0.0 113.057 -172.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 13.1 p -76.43 -58.68 3.14 Favored 'General case' 0 N--CA 1.424 -1.73 0 N-CA-C 107.199 -1.408 . . . . 0.0 107.199 172.432 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.28 122.83 75.55 Favored Pre-proline 0 N--CA 1.43 -1.441 0 CA-C-N 114.625 -1.171 . . . . 0.0 108.236 173.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -81.11 2.24 8.72 Favored 'Trans proline' 0 N--CA 1.463 -0.295 0 C-N-CA 122.34 2.027 . . . . 0.0 112.412 -179.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 28.1 m -60.3 -69.66 0.21 Allowed 'General case' 0 C--N 1.326 -0.443 0 C-N-CA 123.241 0.616 . . . . 0.0 110.1 -179.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -169.91 108.35 0.38 Allowed 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.571 0.7 . . . . 0.0 111.474 174.356 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 32.3 t -100.95 -16.82 7.04 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 N-CA-C 105.921 -1.881 . . . . 0.0 105.921 169.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 20.4 mtm-85 72.82 177.08 0.26 Allowed 'General case' 0 C--N 1.371 1.51 0 CA-C-N 113.522 -1.672 . . . . 0.0 109.274 177.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 5.6 m -133.83 162.33 39.58 Favored 'Isoleucine or valine' 0 C--O 1.197 -1.672 0 C-N-CA 119.564 -0.854 . . . . 0.0 109.664 178.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.53 HD23 HG12 ' A' ' 526' ' ' ILE . 0.9 OUTLIER -134.19 136.52 43.8 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 119.08 0.854 . . . . 0.0 113.172 -171.429 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . 0.454 ' N ' HD22 ' A' ' 511' ' ' LEU . 49.1 tpp -101.83 118.83 37.74 Favored 'General case' 0 CA--C 1.508 -0.658 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 174.239 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.556 HD11 ' HB3' ' A' ' 522' ' ' PHE . 24.2 tp -105.14 126.62 52.28 Favored 'General case' 0 C--N 1.297 -1.715 0 CA-C-O 121.531 0.681 . . . . 0.0 110.183 -177.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 79.6 mt -123.97 135.04 53.38 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 115.307 -0.861 . . . . 0.0 109.184 179.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -89.61 123.44 33.68 Favored 'General case' 0 C--N 1.285 -2.212 0 C-N-CA 120.537 -0.465 . . . . 0.0 110.335 -179.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 47.3 t -98.72 110.19 22.83 Favored 'General case' 0 N--CA 1.416 -2.146 0 N-CA-C 107.013 -1.477 . . . . 0.0 107.013 175.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 31.7 m -68.33 -27.25 66.11 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.655 -0.702 . . . . 0.0 110.494 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -63.17 -44.13 96.29 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.141 -0.936 . . . . 0.0 110.422 -176.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -103.79 1.09 31.2 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.821 -177.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . 0.421 0.0 OUTLIER 49.15 34.92 6.44 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 127.11 2.164 . . . . 0.0 114.421 -176.352 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -137.62 167.83 21.94 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.802 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.095 -176.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.614 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 70.0 m-85 -98.19 136.79 37.9 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 120.089 -0.644 . . . . 0.0 110.233 -177.784 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -119.56 145.91 45.96 Favored 'General case' 0 C--N 1.291 -1.941 0 N-CA-C 107.407 -1.331 . . . . 0.0 107.407 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -156.23 154.12 25.27 Favored Glycine 0 N--CA 1.425 -2.054 0 C-N-CA 118.285 -1.912 . . . . 0.0 113.516 -178.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.516 ' O ' ' HD3' ' A' ' 527' ' ' PRO . 10.6 mp -115.37 135.02 54.56 Favored 'General case' 0 C--N 1.299 -1.608 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 171.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.53 HG12 HD23 ' A' ' 511' ' ' LEU . 16.5 mt -101.36 107.45 50.84 Favored Pre-proline 0 N--CA 1.439 -0.983 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 177.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.568 ' HG2' ' CD2' ' A' ' 533' ' ' PHE . 35.9 Cg_exo -72.19 138.46 30.62 Favored 'Trans proline' 0 C--O 1.292 3.179 0 C-N-CA 122.994 2.463 . . . . 0.0 111.944 170.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -77.07 -43.07 35.74 Favored 'General case' 0 CA--C 1.5 -0.968 0 CA-C-N 113.526 -1.67 . . . . 0.0 111.302 -177.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -78.41 92.25 4.57 Favored 'General case' 0 CA--C 1.501 -0.908 0 CA-C-O 121.64 0.734 . . . . 0.0 110.156 -176.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . 0.253 0.0 OUTLIER -67.21 -31.08 71.21 Favored 'General case' 0 N--CA 1.426 -1.629 0 CA-C-N 114.959 -1.018 . . . . 0.0 113.569 -179.367 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 16.3 m -62.83 -47.55 82.9 Favored 'General case' 0 CA--C 1.542 0.672 0 N-CA-C 111.655 0.243 . . . . 0.0 111.655 -176.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -74.98 -34.69 52.07 Favored Glycine 0 N--CA 1.441 -0.987 0 C-N-CA 120.744 -0.741 . . . . 0.0 112.229 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.568 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 49.9 t80 -68.36 -48.08 65.73 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 110.121 -0.326 . . . . 0.0 110.121 -178.873 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . 0.505 HG22 ' NE2' ' A' ' 499' ' ' HIS . 95.2 t -64.44 -39.12 84.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 O-C-N 123.181 0.3 . . . . 0.0 110.508 -178.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -67.12 -40.38 86.8 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 109.762 177.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -64.09 -46.53 90.96 Favored Glycine 0 N--CA 1.449 -0.493 0 N-CA-C 111.159 -0.776 . . . . 0.0 111.159 177.528 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.532 ' O ' HG13 ' A' ' 541' ' ' ILE . 43.7 mm -64.01 -37.38 79.65 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.962 0 C-N-CA 122.247 0.219 . . . . 0.0 110.799 178.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 44.4 ttm180 -57.87 -39.67 78.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.995 0.426 . . . . 0.0 110.119 175.22 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . 0.528 ' HA ' HG22 ' A' ' 542' ' ' THR . 49.0 mt-30 -67.66 -34.09 76.23 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.077 176.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 91.1 t -67.41 -48.82 76.21 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-N 116.17 -0.468 . . . . 0.0 109.748 175.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.532 HG13 ' O ' ' A' ' 537' ' ' ILE . 62.2 mt -60.97 -44.88 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 CA-C-N 116.027 -0.533 . . . . 0.0 109.835 179.727 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . 0.546 ' HA ' ' OE2' ' A' ' 545' ' ' GLU . 1.9 t -67.86 -33.55 74.97 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.822 -179.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -66.25 -42.55 88.42 Favored 'General case' 0 C--O 1.194 -1.847 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 175.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.79 -32.93 69.77 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.577 0.751 . . . . 0.0 110.664 178.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . 0.546 ' OE2' ' HA ' ' A' ' 542' ' ' THR . 44.3 mt-10 -59.97 -37.58 80.04 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.865 0.364 . . . . 0.0 111.099 175.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 17.8 m-70 -97.76 -16.07 20.03 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-O 121.362 0.601 . . . . 0.0 110.613 -177.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -72.67 135.05 45.34 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.033 -175.028 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 72.7 m80 -82.08 92.95 6.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-O 121.309 0.576 . . . . 0.0 109.491 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 10.1 p80 -83.48 174.02 10.97 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.335 177.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 76.3 t60 -69.29 96.9 0.89 Allowed 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.524 0.678 . . . . 0.0 109.6 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 10.4 t60 . . . . . 0 C--N 1.287 -2.137 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 -178.891 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 68.2 mtm . . . . . 0 CA--C 1.503 -0.831 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 23.0 t -108.73 145.54 34.93 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 178.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 61.8 t -80.79 131.05 34.85 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.181 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 179.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 27.7 m -71.51 123.45 22.45 Favored 'General case' 0 N--CA 1.419 -2.004 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.445 -179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -72.37 -26.16 61.79 Favored 'General case' 0 CA--C 1.5 -0.956 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 174.17 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.82 144.02 18.81 Favored 'General case' 0 N--CA 1.425 -1.712 0 CA-C-N 114.215 -1.357 . . . . 0.0 107.759 175.473 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.48 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.2 mp -108.68 136.29 48.51 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -177.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 64.1 tp -70.1 118.83 13.43 Favored 'General case' 0 C--N 1.321 -0.63 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 177.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -112.19 -51.24 2.86 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 112.642 0.608 . . . . 0.0 112.642 -174.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.499 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 78.4 t90 -155.19 149.21 25.72 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 120.601 -0.44 . . . . 0.0 110.459 -172.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 13.1 p -130.61 117.63 19.81 Favored 'General case' 0 C--N 1.288 -2.103 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 176.695 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.499 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -159.54 -172.53 26.83 Favored Glycine 0 N--CA 1.433 -1.562 0 C-N-CA 119.795 -1.193 . . . . 0.0 112.589 -175.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 59.8 t -112.03 136.69 47.43 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 CA-C-O 121.099 0.476 . . . . 0.0 109.876 -176.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.526 HD13 ' SG ' ' A' ' 429' ' ' CYS . 10.4 mp -113.19 139.08 49.07 Favored 'General case' 0 CA--C 1.483 -1.606 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.729 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.491 ' HG3' ' HB3' ' A' ' 426' ' ' SER . 30.2 tt0 -116.22 126.83 54.16 Favored 'General case' 0 N--CA 1.417 -2.079 0 N-CA-C 108.056 -1.09 . . . . 0.0 108.056 -178.411 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . 0.456 ' HB3' ' HG3' ' A' ' 450' ' ' MET . 19.3 p-90 -107.15 131.86 53.66 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-O 121.46 0.647 . . . . 0.0 112.584 -175.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -106.67 138.82 42.13 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-N 114.46 -1.245 . . . . 0.0 109.227 -177.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -44.34 -60.52 1.89 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.934 1.294 . . . . 0.0 111.425 178.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -156.72 147.28 16.12 Favored Pre-proline 0 N--CA 1.426 -1.668 0 N-CA-C 106.077 -1.823 . . . . 0.0 106.077 -178.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_exo -50.43 113.91 1.23 Allowed 'Trans proline' 0 CA--C 1.54 0.805 0 C-N-CA 122.726 2.284 . . . . 0.0 111.753 174.078 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 64.6 mttp 71.09 80.27 0.19 Allowed Pre-proline 0 N--CA 1.473 0.716 0 C-N-CA 124.633 1.173 . . . . 0.0 112.993 -179.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -105.4 39.07 0.04 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.099 0 C-N-CA 123.737 2.958 . . . . 0.0 109.706 175.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -82.6 -34.12 27.74 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 115.68 -0.691 . . . . 0.0 112.17 -174.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 5.6 p -94.6 -53.09 4.02 Favored 'General case' 0 C--N 1.301 -1.529 0 C-N-CA 120.577 -0.449 . . . . 0.0 110.823 179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.29 120.54 63.17 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.049 0 N-CA-C 107.926 -1.138 . . . . 0.0 107.926 176.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . 0.406 ' HB2' HG23 ' A' ' 421' ' ' THR . 7.2 p-10 -115.36 148.18 39.61 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 178.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -86.61 -39.89 15.69 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 178.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -160.99 88.43 0.76 Allowed 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.388 1.075 . . . . 0.0 110.591 174.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . 0.406 HG23 ' HB2' ' A' ' 418' ' ' ASP . 2.9 p -79.16 -96.05 0.03 OUTLIER 'General case' 0 C--N 1.314 -0.944 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.033 173.243 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt 62.67 -68.0 0.08 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.679 1.592 . . . . 0.0 111.185 -178.4 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 52.7 tp -146.44 132.17 18.95 Favored 'General case' 0 C--N 1.277 -2.565 0 N-CA-C 106.28 -1.748 . . . . 0.0 106.28 -178.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . . . . . . . . . 1.5 m -76.35 146.83 38.53 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 105.731 -1.951 . . . . 0.0 105.731 175.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -106.23 144.29 33.13 Favored 'General case' 0 N--CA 1.416 -2.164 0 C-N-CA 117.159 -1.816 . . . . 0.0 111.321 -178.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.491 ' HB3' ' HG3' ' A' ' 407' ' ' GLU . 51.4 p -142.2 138.55 31.57 Favored 'General case' 0 N--CA 1.409 -2.506 0 N-CA-C 108.202 -1.036 . . . . 0.0 108.202 -177.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . . . . . . . . . 81.1 mt -135.41 135.77 23.0 Favored Pre-proline 0 C--N 1.307 -1.242 0 O-C-N 122.852 0.095 . . . . 0.0 110.861 -175.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -74.45 135.93 20.9 Favored 'Trans proline' 0 C--O 1.253 1.252 0 C-N-CA 122.573 2.182 . . . . 0.0 112.043 177.577 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . 0.526 ' SG ' HD13 ' A' ' 406' ' ' LEU . 20.3 p -142.29 167.13 22.84 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.493 -178.459 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -115.79 129.88 56.62 Favored 'General case' 0 C--N 1.308 -1.224 0 N-CA-C 106.244 -1.761 . . . . 0.0 106.244 178.053 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 45.3 t -114.05 123.98 70.25 Favored 'Isoleucine or valine' 0 C--O 1.262 1.719 0 CA-C-O 122.143 0.973 . . . . 0.0 110.792 -175.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 71.5 m-85 -113.47 160.42 18.48 Favored 'General case' 0 C--N 1.281 -2.391 0 CA-C-N 114.035 -1.439 . . . . 0.0 107.39 179.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 471' ' ' VAL . 15.4 m -122.75 141.77 41.87 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.076 0 CA-C-O 120.694 0.283 . . . . 0.0 111.6 179.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 470' ' ' MET . 3.0 m120 -94.59 132.16 39.59 Favored 'General case' 1 C--O 1.314 4.448 0 N-CA-C 107.818 -1.178 . . . . 0.0 107.818 168.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.48 ' CD2' HD11 ' A' ' 399' ' ' LEU . 73.4 m-70 -39.26 165.72 0.0 OUTLIER 'General case' 0 C--N 1.37 1.463 0 O-C-N 127.387 2.929 . . . . 0.0 116.197 -168.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.33 -2.39 31.1 Favored Glycine 0 CA--C 1.502 -0.766 0 N-CA-C 109.096 -1.601 . . . . 0.0 109.096 -174.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.409 ' CB ' ' HD3' ' A' ' 469' ' ' ARG . 0.2 OUTLIER -106.63 161.91 14.22 Favored 'General case' 0 N--CA 1.419 -2.021 0 CA-C-N 114.05 -1.075 . . . . 0.0 113.118 -174.439 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -160.88 94.49 1.03 Allowed 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 164.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . 0.512 ' HB3' ' NH1' ' A' ' 469' ' ' ARG . 2.3 pt? -141.92 151.22 42.41 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.252 178.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -102.47 135.49 44.0 Favored 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.256 -1.757 . . . . 0.0 106.256 168.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.432 HG21 ' HB2' ' A' ' 402' ' ' TRP . 14.0 p -94.6 23.15 5.54 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -171.785 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -75.55 -28.33 58.97 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.255 177.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 6.3 tp60 -72.07 -15.52 62.01 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.208 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 19.1 m0 -88.24 126.84 59.32 Favored Pre-proline 0 C--N 1.311 -1.07 0 CA-C-N 115.172 -0.922 . . . . 0.0 109.455 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . 0.435 ' HG2' ' HD2' ' A' ' 501' ' ' PRO . 23.5 Cg_exo -69.84 157.88 58.73 Favored 'Trans proline' 0 C--O 1.224 -0.223 0 C-N-CA 122.186 1.924 . . . . 0.0 110.05 173.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 20.8 pt20 -77.35 -5.98 51.62 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.128 0.489 . . . . 0.0 111.962 -178.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.4 mmmm -119.9 124.94 47.27 Favored 'General case' 0 C--N 1.314 -0.959 0 N-CA-C 107.685 -1.228 . . . . 0.0 107.685 174.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . 0.419 ' HB2' ' HG ' ' A' ' 406' ' ' LEU . 53.2 mt -118.17 146.69 44.01 Favored 'General case' 0 C--N 1.309 -1.178 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 176.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 71.8 mt -101.93 117.79 47.78 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.749 0 C-N-CA 120.608 -0.437 . . . . 0.0 109.887 -176.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.456 ' HG3' ' HB3' ' A' ' 408' ' ' TRP . 23.3 ptm -112.82 128.96 56.58 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 121.586 0.708 . . . . 0.0 110.067 178.016 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -114.76 130.75 56.89 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -178.282 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -80.99 124.63 29.31 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-O 121.498 0.666 . . . . 0.0 111.503 -178.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.6 pt -133.82 161.42 63.84 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 124.395 1.078 . . . . 0.0 108.814 -177.55 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 16.6 Cg_exo -65.64 128.98 21.18 Favored 'Trans proline' 0 C--N 1.356 0.97 0 C-N-CA 121.385 1.39 . . . . 0.0 111.406 179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 18.4 tm0? -63.86 -26.61 68.69 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.586 0.754 . . . . 0.0 110.388 -178.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 9.6 mm100 -57.27 -33.02 67.19 Favored 'General case' 0 C--N 1.318 -0.781 0 C-N-CA 124.335 1.054 . . . . 0.0 112.7 -174.067 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' A' ' 540' ' ' VAL . 90.8 mt -87.06 8.79 22.03 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -177.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 39.0 tp -69.73 -22.68 63.36 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.303 0.573 . . . . 0.0 110.483 179.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 5.1 m -65.62 -29.52 70.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.671 -179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 9.9 m -72.04 -20.39 61.69 Favored 'General case' 0 CA--C 1.551 1.011 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.757 -179.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 83.1 mt -96.03 10.33 37.85 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.599 -175.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -45.22 -51.5 8.99 Favored Glycine 0 CA--C 1.553 2.462 0 N-CA-C 115.69 1.036 . . . . 0.0 115.69 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 21.5 Cg_endo -62.1 -19.5 66.6 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 122.893 2.395 . . . . 0.0 113.94 -179.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -80.16 -42.36 23.57 Favored 'General case' 0 C--N 1.318 -0.796 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 178.191 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -71.68 -13.66 61.8 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 115.355 -0.839 . . . . 0.0 111.583 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 61.0 ttp180 -53.86 -31.79 50.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 114.793 -1.094 . . . . 0.0 110.14 175.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 39.8 t30 -138.13 97.84 3.49 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 177.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 49.9 m -150.4 170.21 19.59 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.292 0.568 . . . . 0.0 111.553 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.512 ' NH1' ' HB3' ' A' ' 439' ' ' LEU . 97.3 mtt180 -112.52 142.51 45.0 Favored 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 106.837 -1.542 . . . . 0.0 106.837 179.017 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.669 ' HB2' ' HB2' ' A' ' 434' ' ' ASN . 61.5 mtp -98.78 151.96 20.22 Favored 'General case' 0 CA--C 1.491 -1.318 0 C-N-CA 116.944 -1.903 . . . . 0.0 111.242 -173.373 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.575 HG12 HG12 ' A' ' 433' ' ' VAL . 26.4 m -135.09 155.39 37.79 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.443 0 CA-C-N 115.717 -0.674 . . . . 0.0 109.891 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -127.76 129.76 47.59 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 173.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 25.0 m-85 -112.88 117.98 33.63 Favored 'General case' 0 C--N 1.282 -2.326 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.847 179.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 43.4 t-80 -121.31 123.73 42.88 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 174.415 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . 0.402 ' CD1' ' HB3' ' A' ' 429' ' ' CYS . 57.8 m-85 -81.02 153.14 27.58 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.624 -179.817 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . 0.4 ' OG1' ' HG2' ' A' ' 478' ' ' LYS . 18.8 p -71.58 -9.96 59.03 Favored 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 113.649 0.981 . . . . 0.0 113.649 -173.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 89.4 m-20 63.17 28.02 15.82 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.481 0.713 . . . . 0.0 111.231 179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.586 ' HE2' ' HA ' ' A' ' 478' ' ' LYS . 10.7 mmpt? -64.82 -46.08 83.47 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 116.174 -0.466 . . . . 0.0 111.272 179.676 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -130.47 102.38 6.14 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 80.7 mt -66.19 -33.74 76.44 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.261 -174.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 37.1 mt-10 -70.5 -36.55 73.86 Favored 'General case' 0 C--N 1.316 -0.876 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.944 -178.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 38.7 m -65.09 -38.0 89.34 Favored 'General case' 0 C--O 1.244 0.799 0 N-CA-C 109.648 -0.501 . . . . 0.0 109.648 174.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . . . . . . . . . 86.0 mt -66.13 -41.86 89.91 Favored 'General case' 0 C--O 1.209 -1.059 0 CA-C-N 115.51 -0.768 . . . . 0.0 111.007 176.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 62.6 tttm -54.41 -41.26 69.11 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 123.037 0.535 . . . . 0.0 111.6 -178.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.488 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -63.15 -46.51 93.05 Favored Glycine 0 N--CA 1.448 -0.519 0 C-N-CA 120.873 -0.68 . . . . 0.0 111.708 178.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.0 tp -66.7 -41.59 87.77 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 122.73 0.412 . . . . 0.0 110.737 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . . . . . . . . . 4.7 m-30 -61.16 -38.89 88.09 Favored 'General case' 0 CA--C 1.507 -0.677 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.237 178.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 4.1 tmm_? -66.39 -46.0 78.13 Favored 'General case' 0 C--O 1.211 -0.953 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.488 HG13 ' O ' ' A' ' 485' ' ' GLY . 67.6 mt -62.55 -51.15 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.335 0 CA-C-O 120.798 0.332 . . . . 0.0 110.892 -178.684 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . 0.487 ' SD ' ' HE1' ' A' ' 522' ' ' PHE . 85.3 mtp -73.46 -36.19 65.84 Favored 'General case' 0 C--N 1.309 -1.161 0 CA-C-O 121.117 0.484 . . . . 0.0 111.558 -176.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.65 -19.34 71.03 Favored Glycine 0 C--O 1.219 -0.804 0 CA-C-N 115.87 -0.604 . . . . 0.0 111.602 177.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -83.5 4.97 25.62 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 124.036 0.934 . . . . 0.0 110.611 179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 99.57 29.52 6.96 Favored Glycine 0 C--N 1.316 -0.581 0 C-N-CA 120.398 -0.906 . . . . 0.0 113.042 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 57.8 m-85 -112.61 147.38 36.82 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 174.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -118.61 159.98 22.62 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -119.05 115.87 3.19 Favored Glycine 0 N--CA 1.421 -2.327 0 C-N-CA 120.189 -1.005 . . . . 0.0 110.721 -179.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . 0.43 ' O ' ' HA ' ' A' ' 450' ' ' MET . 42.1 t -88.32 128.3 35.49 Favored 'General case' 0 C--N 1.291 -1.958 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 75.6 t -100.99 120.57 50.69 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.832 0 CA-C-O 121.664 0.745 . . . . 0.0 109.3 -177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 70.7 m80 -113.42 134.66 54.53 Favored 'General case' 0 C--N 1.283 -2.318 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 175.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 92.1 m-85 -84.12 132.24 48.58 Favored Pre-proline 0 C--N 1.289 -2.061 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.035 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . 0.435 ' HD2' ' HG2' ' A' ' 445' ' ' PRO . 31.4 Cg_exo -62.71 3.4 0.51 Allowed 'Trans proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.595 2.863 . . . . 0.0 114.72 176.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 49.1 m170 -103.2 115.76 31.19 Favored 'General case' 0 C--N 1.271 -2.835 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 172.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 15.6 p -110.41 35.21 3.53 Favored 'General case' 0 C--N 1.292 -1.9 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.571 -176.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -71.54 126.5 91.65 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.264 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.02 -6.51 13.03 Favored 'Trans proline' 0 N--CA 1.485 1.001 0 C-N-CA 123.301 2.667 . . . . 0.0 112.042 -179.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 56.1 m -74.53 0.08 15.96 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.388 -0.823 . . . . 0.0 110.439 176.623 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 80.73 93.93 0.05 OUTLIER 'General case' 0 C--O 1.244 0.785 0 N-CA-C 115.269 1.581 . . . . 0.0 115.269 170.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.0 t -91.03 -16.14 8.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 107.646 -1.242 . . . . 0.0 107.646 172.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 56.0 mtt180 75.14 -178.67 0.16 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 125.395 1.478 . . . . 0.0 109.754 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.567 ' O ' HG13 ' A' ' 526' ' ' ILE . 6.7 m -138.14 162.83 30.34 Favored 'Isoleucine or valine' 0 C--O 1.199 -1.602 0 C-N-CA 119.854 -0.739 . . . . 0.0 109.855 176.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.57 HD13 ' HB ' ' A' ' 526' ' ' ILE . 17.7 tp -135.01 150.04 50.26 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -170.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 40.2 tpp -108.93 140.78 41.95 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 175.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.529 HD11 ' HB3' ' A' ' 522' ' ' PHE . 52.7 tp -125.57 122.89 37.81 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.244 0.545 . . . . 0.0 109.952 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 73.3 mt -126.98 139.31 53.13 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.749 -0.66 . . . . 0.0 110.114 -179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 35.7 t80 -93.83 124.55 37.9 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 120.349 -0.54 . . . . 0.0 109.559 178.018 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 16.9 m -106.7 110.58 22.8 Favored 'General case' 0 N--CA 1.416 -2.132 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 176.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 18.5 m -68.57 -35.68 77.71 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 114.834 -1.075 . . . . 0.0 113.218 -174.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 28.8 tptp -77.3 -29.41 53.69 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-O 121.449 0.643 . . . . 0.0 110.113 -178.009 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -87.32 -10.62 51.78 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-N 115.514 -0.766 . . . . 0.0 109.89 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 58.24 27.41 15.13 Favored 'General case' 0 C--N 1.345 0.371 0 C-N-CA 124.876 1.27 . . . . 0.0 111.709 -178.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.33 166.58 12.48 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.568 0 CA-C-O 121.232 0.539 . . . . 0.0 111.688 -176.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.626 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 42.5 m-85 -98.49 138.57 35.52 Favored 'General case' 0 N--CA 1.408 -2.569 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 176.005 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 58.3 ttp -133.35 143.08 48.74 Favored 'General case' 0 C--N 1.276 -2.598 0 N-CA-C 107.376 -1.342 . . . . 0.0 107.376 -178.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . 0.429 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -151.89 158.94 28.05 Favored Glycine 0 N--CA 1.414 -2.77 0 C-N-CA 119.253 -1.451 . . . . 0.0 112.475 -178.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.479 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 10.3 mp -115.3 139.45 49.96 Favored 'General case' 0 C--N 1.291 -1.94 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 171.638 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.57 ' HB ' HD13 ' A' ' 511' ' ' LEU . 4.9 tt -107.05 108.32 61.81 Favored Pre-proline 0 C--O 1.254 1.324 0 CA-C-O 120.941 0.4 . . . . 0.0 111.65 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.516 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 23.2 Cg_exo -72.12 138.66 31.17 Favored 'Trans proline' 0 C--O 1.294 3.294 0 C-N-CA 123.433 2.755 . . . . 0.0 113.066 172.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -71.3 -45.32 63.34 Favored 'General case' 0 CA--C 1.506 -0.744 0 CA-C-N 113.114 -1.857 . . . . 0.0 111.264 -178.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -83.02 104.69 13.41 Favored 'General case' 0 CA--C 1.496 -1.105 0 CA-C-O 121.364 0.602 . . . . 0.0 111.166 -174.446 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.12 -36.07 81.12 Favored 'General case' 0 C--N 1.298 -1.66 0 CA-C-N 114.893 -1.048 . . . . 0.0 111.626 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 80.3 p -63.71 -47.66 80.22 Favored 'General case' 0 C--O 1.218 -0.589 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -173.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -72.1 -38.74 59.32 Favored Glycine 0 N--CA 1.434 -1.477 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.432 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.497 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 44.9 t80 -71.05 -47.36 58.94 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 120.595 -0.442 . . . . 0.0 111.245 -177.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 97.8 t -63.55 -38.53 82.48 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 CA-C-O 121.318 0.58 . . . . 0.0 109.61 179.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -59.59 -41.47 90.35 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.425 -0.807 . . . . 0.0 109.809 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -67.85 -41.81 87.58 Favored Glycine 0 N--CA 1.443 -0.879 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.176 178.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.497 ' O ' HG13 ' A' ' 541' ' ' ILE . 47.6 mm -61.55 -36.7 74.93 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 122.492 0.317 . . . . 0.0 110.433 177.534 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 25.9 tpt180 -56.39 -38.69 71.82 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 120.863 0.363 . . . . 0.0 110.525 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -67.3 -41.8 84.79 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.408 ' HA ' HD13 ' A' ' 457' ' ' LEU . 54.4 t -63.28 -43.87 98.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.118 178.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.497 HG13 ' O ' ' A' ' 537' ' ' ILE . 71.9 mt -59.98 -44.58 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.565 0 CA-C-N 115.573 -0.74 . . . . 0.0 109.464 177.346 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 83.4 m -62.84 -38.94 92.79 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.111 -0.95 . . . . 0.0 111.741 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -67.55 -38.21 83.82 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.087 0.47 . . . . 0.0 110.026 177.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.6 tp -65.57 -27.53 68.49 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.519 -0.764 . . . . 0.0 109.988 178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -71.94 -27.96 63.14 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.003 -0.544 . . . . 0.0 112.068 175.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 25.4 m170 -78.39 -43.25 27.99 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.379 -1.341 . . . . 0.0 107.379 175.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 29.0 t-80 54.7 84.07 0.07 Allowed 'General case' 0 C--O 1.242 0.689 0 C-N-CA 125.284 1.433 . . . . 0.0 112.473 174.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 69.2 t60 -90.63 88.48 7.13 Favored 'General case' 0 N--CA 1.423 -1.782 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 178.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -83.13 146.0 28.9 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 176.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 13.7 p80 -59.14 -52.95 63.49 Favored 'General case' 0 C--N 1.317 -0.839 0 O-C-N 123.628 0.58 . . . . 0.0 110.367 178.138 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 . . . . . 0 C--O 1.247 0.935 0 N-CA-C 105.812 -1.921 . . . . 0.0 105.812 177.103 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.234 0.277 0 N-CA-C 105.748 -1.945 . . . . 0.0 105.748 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . . . . . . . . . 15.7 m 74.32 -62.69 0.45 Allowed 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.805 1.242 . . . . 0.0 112.342 178.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 47.7 t 64.02 95.55 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.416 0 C-N-CA 124.725 1.21 . . . . 0.0 110.768 -177.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 398' ' ' LYS . 31.7 m -95.91 177.92 5.6 Favored 'General case' 0 C--N 1.292 -1.931 0 N-CA-C 109.28 -0.637 . . . . 0.0 109.28 178.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -70.16 -42.72 72.13 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.433 0.635 . . . . 0.0 109.47 179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . 0.432 ' O ' ' HB2' ' A' ' 396' ' ' SER . 63.6 mttp -111.42 160.94 16.63 Favored 'General case' 0 N--CA 1.427 -1.584 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 171.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.446 HD11 ' CD2' ' A' ' 435' ' ' HIS . 3.5 mp -90.33 122.49 33.27 Favored 'General case' 0 C--N 1.284 -2.256 0 C-N-CA 120.782 -0.367 . . . . 0.0 110.096 -175.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 60.0 tp -62.36 116.35 4.98 Favored 'General case' 0 C--O 1.243 0.715 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 175.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -119.29 -52.92 2.26 Favored 'General case' 0 N--CA 1.427 -1.576 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -172.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.54 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 51.4 t90 -146.34 133.66 20.65 Favored 'General case' 0 N--CA 1.439 -0.979 0 C-N-CA 118.85 -1.14 . . . . 0.0 112.71 -170.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 38.5 t -111.2 119.94 40.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 105.162 -2.162 . . . . 0.0 105.162 170.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.54 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.08 -173.46 26.53 Favored Glycine 0 N--CA 1.426 -1.974 0 C-N-CA 119.411 -1.376 . . . . 0.0 112.43 -176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . . . . . . . . . 60.9 t -121.2 142.44 37.35 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.637 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -176.048 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . 0.427 HD11 ' CE1' ' A' ' 473' ' ' PHE . 88.9 mt -112.67 138.49 49.39 Favored 'General case' 0 C--N 1.293 -1.868 0 N-CA-C 107.98 -1.118 . . . . 0.0 107.98 178.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.561 ' HB3' HG22 ' A' ' 424' ' ' THR . 26.3 mt-10 -115.67 125.73 53.23 Favored 'General case' 0 N--CA 1.402 -2.858 0 CA-C-N 115.475 -0.784 . . . . 0.0 108.979 175.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . . . . . . . . . 55.9 p-90 -123.7 148.8 46.22 Favored 'General case' 0 C--N 1.285 -2.227 0 CA-C-N 115.59 -0.732 . . . . 0.0 111.374 -175.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 26.3 tt0 -140.36 143.64 35.84 Favored 'General case' 0 C--N 1.29 -2.011 0 N-CA-C 106.724 -1.584 . . . . 0.0 106.724 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -120.07 172.87 7.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-O 121.02 0.438 . . . . 0.0 111.396 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 48.3 mmtm -120.59 110.79 35.18 Favored Pre-proline 0 C--N 1.312 -1.029 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 177.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -64.74 -56.53 0.39 Allowed 'Trans proline' 0 C--O 1.238 0.492 0 C-N-CA 121.872 1.715 . . . . 0.0 108.907 175.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . . . . . . . . . 39.9 ttpt 164.5 140.72 0.03 OUTLIER Pre-proline 0 CA--C 1.508 -0.638 0 C-N-CA 127.68 2.392 . . . . 0.0 104.731 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -61.98 107.55 0.56 Allowed 'Trans proline' 0 N--CA 1.451 -1.005 0 C-N-CA 121.353 1.369 . . . . 0.0 110.315 173.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -92.43 -8.78 43.78 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-O 122.065 0.936 . . . . 0.0 108.652 176.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.3 t -140.38 -165.78 1.99 Allowed 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 105.995 -1.854 . . . . 0.0 105.995 176.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 7.5 p -73.62 -36.39 47.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.826 0 CA-C-O 121.089 0.471 . . . . 0.0 110.467 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -95.37 118.65 32.5 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 108.967 -0.753 . . . . 0.0 108.967 178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . . . . . . . . . . . -88.43 -3.72 58.77 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 112.91 0.708 . . . . 0.0 112.91 -177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 8.7 t30 -84.9 78.42 9.9 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 122.168 0.985 . . . . 0.0 111.469 -175.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 5.9 t -131.85 72.9 1.51 Allowed 'General case' 0 N--CA 1.418 -2.034 0 CA-C-O 122.975 1.369 . . . . 0.0 109.268 175.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 18.7 tptp -167.54 165.22 14.72 Favored 'General case' 0 N--CA 1.426 -1.674 0 N-CA-C 104.005 -2.591 . . . . 0.0 104.005 178.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 93.4 mt -115.44 152.4 32.97 Favored 'General case' 0 C--N 1.292 -1.918 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 177.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . 0.561 HG22 ' HB3' ' A' ' 407' ' ' GLU . 5.7 m -78.85 130.27 35.49 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.54 -0.911 . . . . 0.0 108.54 -179.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . 0.44 ' O ' ' HA ' ' A' ' 407' ' ' GLU . 31.0 mmt180 -119.46 146.68 45.2 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 120.95 -0.3 . . . . 0.0 111.155 -177.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 407' ' ' GLU . 2.9 p -110.84 139.94 45.72 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 114.377 1.251 . . . . 0.0 114.377 -173.139 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . 0.526 HD13 HD23 ' A' ' 483' ' ' LEU . 77.2 mt -137.12 125.09 14.5 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.124 -0.944 . . . . 0.0 109.985 175.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo -75.23 146.62 32.07 Favored 'Trans proline' 0 C--O 1.248 0.979 0 C-N-CA 122.707 2.271 . . . . 0.0 111.605 177.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 21.7 p -147.49 167.46 24.4 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 116.355 -0.384 . . . . 0.0 110.817 -176.651 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 30.3 mm-40 -116.48 129.89 56.46 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 106.75 -1.574 . . . . 0.0 106.75 175.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 41.4 t -124.87 123.85 66.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.923 0 CA-C-O 121.988 0.899 . . . . 0.0 112.18 -175.762 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -109.13 158.6 17.63 Favored 'General case' 0 C--N 1.296 -1.738 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 471' ' ' VAL . 27.8 m -121.77 139.82 47.66 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 C-N-CA 120.11 -0.636 . . . . 0.0 109.994 177.289 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.795 ' HB3' ' HB2' ' A' ' 470' ' ' MET . 48.6 t30 -95.72 131.83 41.57 Favored 'General case' 1 C--O 1.308 4.158 0 N-CA-C 108.145 -1.057 . . . . 0.0 108.145 174.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.523 ' HA ' ' OE1' ' A' ' 437' ' ' GLU . 29.1 m-70 -37.41 153.19 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.953 0 O-C-N 127.773 3.171 . . . . 0.0 116.448 -167.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.54 -2.42 30.77 Favored Glycine 0 N--CA 1.445 -0.766 0 CA-C-N 114.307 -1.315 . . . . 0.0 109.929 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . 0.523 ' OE1' ' HA ' ' A' ' 435' ' ' HIS . 1.0 OUTLIER -82.36 161.08 22.66 Favored 'General case' 0 N--CA 1.426 -1.636 0 C-N-CA 124.281 1.032 . . . . 0.0 112.638 -173.712 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -146.02 96.05 2.73 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.618 167.031 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . 0.565 HD23 HG23 ' A' ' 441' ' ' THR . 0.0 OUTLIER -140.34 141.37 35.67 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.088 175.175 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -104.06 106.85 17.5 Favored 'General case' 0 C--N 1.292 -1.93 0 N-CA-C 105.107 -2.183 . . . . 0.0 105.107 166.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.565 HG23 HD23 ' A' ' 439' ' ' LEU . 8.1 p -70.13 -12.68 61.77 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.021 0.915 . . . . 0.0 112.588 -175.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -68.49 -22.75 64.53 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 114.901 -1.045 . . . . 0.0 109.63 174.128 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -103.58 12.52 34.88 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-O 122.305 1.05 . . . . 0.0 108.982 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . 0.406 ' HA ' ' HD3' ' A' ' 445' ' ' PRO . 9.9 m0 -93.57 140.55 23.16 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.22 -0.9 . . . . 0.0 110.386 177.467 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 444' ' ' TRP . 16.9 Cg_exo -70.89 144.83 49.05 Favored 'Trans proline' 0 N--CA 1.447 -1.241 0 C-N-CA 122.042 1.828 . . . . 0.0 109.045 171.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 25.8 mp0 -81.35 -5.25 57.65 Favored 'General case' 0 C--N 1.308 -1.211 0 CA-C-O 120.918 0.39 . . . . 0.0 111.183 -178.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -128.25 120.19 26.66 Favored 'General case' 0 C--O 1.245 0.86 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.994 177.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 71.9 mt -116.33 147.18 41.82 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 177.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.9 mm -99.23 123.2 51.76 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-O 120.815 0.34 . . . . 0.0 110.207 -175.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . . . . . . . . . 58.5 ttp -113.26 135.41 53.87 Favored 'General case' 0 C--N 1.307 -1.256 0 CA-C-O 121.109 0.48 . . . . 0.0 111.27 -179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . 0.581 ' HB3' ' SG ' ' A' ' 497' ' ' CYS . 8.1 tp-100 -117.83 131.13 56.6 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 177.546 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.94 125.07 33.8 Favored 'General case' 0 C--N 1.306 -1.323 0 N-CA-C 109.944 -0.391 . . . . 0.0 109.944 -178.99 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 24.9 pt -134.2 159.86 70.73 Favored Pre-proline 0 C--N 1.317 -0.839 0 C-N-CA 123.218 0.607 . . . . 0.0 110.16 -176.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -64.11 129.31 23.98 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 121.861 1.707 . . . . 0.0 112.1 176.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -63.55 -29.52 70.77 Favored 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 123.676 0.79 . . . . 0.0 111.386 179.521 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -57.75 -41.2 81.41 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.132 0.491 . . . . 0.0 111.93 -177.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.403 HD12 HG13 ' A' ' 540' ' ' VAL . 73.8 mt -76.16 -8.73 57.69 Favored 'General case' 0 C--N 1.307 -1.277 0 CA-C-N 115.364 -0.835 . . . . 0.0 111.568 -173.781 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 51.1 tp -70.15 -16.79 63.14 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.582 -177.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 13.5 t -60.5 -25.18 65.89 Favored 'General case' 0 CA--C 1.557 1.225 0 CA-C-O 121.026 0.441 . . . . 0.0 111.316 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 5.3 m -71.31 -19.33 62.33 Favored 'General case' 0 CA--C 1.559 1.302 0 C-N-CA 123.438 0.695 . . . . 0.0 110.652 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -96.0 4.27 52.78 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.999 0.428 . . . . 0.0 111.443 -176.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . -40.32 -54.23 3.28 Favored Glycine 0 CA--C 1.548 2.129 0 CA-C-N 114.319 -1.31 . . . . 0.0 115.583 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . . . . . . . . . 15.5 Cg_endo -58.5 -20.84 51.26 Favored 'Trans proline' 0 CA--C 1.552 1.414 0 C-N-CA 122.914 2.409 . . . . 0.0 114.723 179.278 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -75.72 -36.96 59.8 Favored 'General case' 0 N--CA 1.47 0.534 0 O-C-N 121.835 -0.54 . . . . 0.0 110.884 -178.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -68.97 -13.21 62.31 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.865 -177.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 37.5 mmt180 -61.61 -36.13 79.85 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.826 178.511 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -122.85 89.02 3.03 Favored 'General case' 0 CA--C 1.487 -1.46 0 CA-C-O 121.818 0.818 . . . . 0.0 109.592 175.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . 0.402 ' HB2' HD23 ' A' ' 525' ' ' LEU . 49.3 m -144.14 160.17 41.38 Favored 'General case' 0 N--CA 1.415 -2.219 0 CA-C-N 114.735 -1.12 . . . . 0.0 109.342 -178.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . . . . . . . . . 25.0 ptt180 -111.23 141.93 44.1 Favored 'General case' 0 C--N 1.284 -2.269 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.795 ' HB2' ' HB3' ' A' ' 434' ' ' ASN . 72.4 mtp -98.39 153.01 18.88 Favored 'General case' 0 N--CA 1.431 -1.412 0 C-N-CA 118.036 -1.466 . . . . 0.0 112.159 -170.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.53 ' HA ' ' HA ' ' A' ' 433' ' ' VAL . 22.1 m -134.18 162.15 39.6 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.236 0 CA-C-N 115.346 -0.843 . . . . 0.0 109.596 179.189 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 52.5 tt0 -133.29 123.08 24.84 Favored 'General case' 0 C--N 1.293 -1.865 0 N-CA-C 107.647 -1.242 . . . . 0.0 107.647 173.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 17.2 m-85 -107.72 134.39 50.76 Favored 'General case' 0 C--N 1.288 -2.082 0 O-C-N 123.898 0.749 . . . . 0.0 110.068 179.21 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -133.93 123.51 24.81 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 106.222 -1.77 . . . . 0.0 106.222 172.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.2 m-85 -87.34 152.84 21.93 Favored 'General case' 0 C--N 1.289 -2.03 0 C-N-CA 121.204 -0.198 . . . . 0.0 110.761 -178.19 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 10.9 t -76.96 119.03 20.13 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-O 121.843 0.83 . . . . 0.0 109.211 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 50.0 m-80 -80.26 38.18 0.41 Allowed 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 115.573 -0.74 . . . . 0.0 112.125 -176.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -84.48 -36.67 22.11 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.24 177.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -115.11 87.57 2.68 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.865 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 96.3 mt -66.79 -28.94 68.79 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.676 -177.357 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -70.64 -41.7 71.82 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 112.728 0.64 . . . . 0.0 112.728 -178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 9.3 t -67.75 -43.07 80.74 Favored 'General case' 0 C--O 1.245 0.835 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 178.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.526 HD23 HD13 ' A' ' 427' ' ' LEU . 83.8 mt -64.69 -30.16 71.17 Favored 'General case' 0 C--O 1.211 -0.968 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.84 178.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.471 ' O ' ' HG2' ' A' ' 488' ' ' ARG . 88.0 tttt -54.99 -47.27 74.82 Favored 'General case' 0 C--N 1.324 -0.533 0 C-N-CA 123.115 0.566 . . . . 0.0 110.817 -178.331 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . . . . . . . . . . . -64.38 -42.04 97.85 Favored Glycine 0 N--CA 1.444 -0.791 0 C-N-CA 120.906 -0.664 . . . . 0.0 111.957 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 5.8 tt -65.03 -45.05 87.06 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 109.166 -0.679 . . . . 0.0 109.166 -179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 483' ' ' LEU . 18.0 m-85 -60.31 -40.3 90.09 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.285 177.22 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . 0.562 ' HA ' ' CZ ' ' A' ' 488' ' ' ARG . 2.6 mmp_? -62.92 -50.28 71.46 Favored 'General case' 0 C--O 1.216 -0.697 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.714 177.184 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . . . . . . . . . 76.3 mt -57.71 -45.47 86.81 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.467 0 C-N-CA 122.703 0.401 . . . . 0.0 110.649 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 19.0 mmt -63.92 -43.87 94.59 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.312 178.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -67.93 -22.59 74.04 Favored Glycine 0 CA--C 1.526 0.77 0 CA-C-N 116.337 -0.392 . . . . 0.0 112.335 179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -76.76 -7.02 54.59 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.822 0.449 . . . . 0.0 111.641 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.4 30.4 6.96 Favored Glycine 0 N--CA 1.437 -1.266 0 C-N-CA 119.373 -1.394 . . . . 0.0 112.482 179.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.73 162.24 13.7 Favored 'General case' 0 C--N 1.301 -1.541 0 N-CA-C 109.858 -0.423 . . . . 0.0 109.858 175.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -125.18 158.35 34.19 Favored 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -117.41 108.24 1.67 Allowed Glycine 0 N--CA 1.426 -1.988 0 C-N-CA 120.3 -0.952 . . . . 0.0 111.601 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . 0.581 ' SG ' ' HB3' ' A' ' 451' ' ' GLN . 10.6 p -83.87 118.55 24.04 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 44.4 t -104.4 121.28 55.93 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.455 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 -176.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -111.17 136.09 50.74 Favored 'General case' 0 C--N 1.285 -2.206 0 CA-C-N 115.55 -0.75 . . . . 0.0 109.219 178.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -97.64 133.46 23.54 Favored Pre-proline 0 C--N 1.291 -1.959 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 -179.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -65.73 92.3 0.25 Allowed 'Trans proline' 0 N--CA 1.454 -0.838 0 N-CA-C 107.909 -1.612 . . . . 0.0 107.909 169.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 8.2 p80 -77.47 130.48 37.06 Favored 'General case' 0 C--N 1.316 -0.854 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 -170.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . . . . . . . . . 4.2 m -84.12 -49.77 8.56 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 115.2 -0.909 . . . . 0.0 108.614 177.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -84.44 147.79 50.69 Favored Pre-proline 0 N--CA 1.439 -1.014 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.372 -178.562 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 96.8 Cg_endo -90.27 -22.17 0.8 Allowed 'Trans proline' 0 CA--C 1.55 1.289 0 C-N-CA 122.172 1.914 . . . . 0.0 113.547 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 14.4 t -117.07 19.31 14.31 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.836 0.827 . . . . 0.0 108.975 -176.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -160.19 164.38 32.88 Favored 'General case' 0 N--CA 1.433 -1.275 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 178.287 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 48.0 t 75.55 97.54 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.52 -0.209 0 N-CA-C 107.416 -1.328 . . . . 0.0 107.416 -172.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . 0.559 ' HB3' ' O ' ' A' ' 527' ' ' PRO . 11.1 mmt180 -98.06 -166.76 1.42 Allowed 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 113.681 -1.599 . . . . 0.0 110.091 -168.097 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.501 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 22.6 m -121.53 163.07 19.93 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.151 0 C-N-CA 119.102 -1.039 . . . . 0.0 110.944 -177.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.559 ' HB2' HG12 ' A' ' 526' ' ' ILE . 14.4 tp -130.91 145.81 52.13 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -170.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 32.4 tpp -113.42 120.71 41.98 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.287 -0.87 . . . . 0.0 109.308 173.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.439 HD11 ' HB3' ' A' ' 522' ' ' PHE . 45.9 tp -105.87 126.8 52.61 Favored 'General case' 0 C--N 1.3 -1.582 0 CA-C-O 121.226 0.536 . . . . 0.0 110.076 -179.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 80.7 mt -132.36 148.75 52.43 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.284 -0.871 . . . . 0.0 109.435 -179.284 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -104.25 128.65 52.02 Favored 'General case' 0 C--N 1.289 -2.025 0 CA-C-O 120.702 0.286 . . . . 0.0 110.773 -178.197 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 18.8 m -107.86 110.66 22.49 Favored 'General case' 0 N--CA 1.42 -1.963 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 6.5 p -68.18 -35.87 78.71 Favored 'General case' 0 C--N 1.309 -1.181 0 C-N-CA 124.43 1.092 . . . . 0.0 113.218 -175.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp -72.86 -33.38 66.06 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 -174.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . . . . . . . . . 56.4 mtmt -97.39 -3.65 39.86 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 120.409 -0.517 . . . . 0.0 110.42 177.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . 0.404 ' HD2' ' HA ' ' A' ' 520' ' ' LYS . 24.9 tptp 59.67 36.62 22.5 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.795 1.238 . . . . 0.0 111.298 177.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . . . . . . . . . 2.7 pp -140.66 165.59 20.12 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.981 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.044 -177.293 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.474 ' HB2' ' HB2' ' A' ' 473' ' ' PHE . 39.7 m-85 -103.39 132.52 49.58 Favored 'General case' 0 N--CA 1.421 -1.914 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 178.268 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 27.0 ptm -110.8 157.6 19.61 Favored 'General case' 0 C--N 1.286 -2.19 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 -179.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . 0.406 ' O ' HG22 ' A' ' 471' ' ' VAL . . . -164.23 143.59 8.69 Favored Glycine 0 N--CA 1.405 -3.418 0 C-N-CA 119.094 -1.527 . . . . 0.0 112.021 178.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . 0.492 ' HG ' ' HG2' ' A' ' 470' ' ' MET . 11.0 mp -114.92 137.74 51.63 Favored 'General case' 0 C--N 1.282 -2.358 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 172.626 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.559 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.8 mt -107.11 106.97 59.75 Favored Pre-proline 0 N--CA 1.428 -1.551 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 177.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.559 ' O ' ' HB3' ' A' ' 509' ' ' ARG . 29.4 Cg_exo -70.32 134.01 25.82 Favored 'Trans proline' 0 C--O 1.292 3.212 0 C-N-CA 123.186 2.591 . . . . 0.0 112.189 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 80.7 m-85 -76.78 -27.43 55.28 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 113.37 -1.741 . . . . 0.0 112.058 179.625 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -90.04 90.11 7.99 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 107.717 -1.216 . . . . 0.0 107.717 177.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -66.82 -33.69 76.17 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.926 -178.192 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 1.4 p -58.27 -48.32 80.81 Favored 'General case' 0 N--CA 1.436 -1.143 0 N-CA-C 113.878 1.066 . . . . 0.0 113.878 -174.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.76 -34.36 43.69 Favored Glycine 0 N--CA 1.437 -1.239 0 C-N-CA 120.333 -0.937 . . . . 0.0 111.801 -179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . 0.407 ' CD2' ' HG2' ' A' ' 527' ' ' PRO . 51.6 t80 -68.52 -47.7 66.27 Favored 'General case' 0 N--CA 1.438 -1.066 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 -177.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . 0.497 ' O ' ' HG3' ' A' ' 538' ' ' ARG . 89.6 t -62.65 -40.69 89.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.593 0 O-C-N 123.352 0.407 . . . . 0.0 110.22 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 24.5 t30 -57.64 -45.93 84.82 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-O 120.839 0.352 . . . . 0.0 110.945 177.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . 0.447 ' O ' HG23 ' A' ' 540' ' ' VAL . . . -69.18 -44.95 63.7 Favored Glycine 0 N--CA 1.446 -0.665 0 C-N-CA 120.322 -0.942 . . . . 0.0 111.73 179.594 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . . . . . . . . . 41.8 mm -63.32 -34.07 64.9 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.458 0 C-N-CA 122.558 0.343 . . . . 0.0 111.754 -179.3 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . 0.497 ' HG3' ' O ' ' A' ' 534' ' ' VAL . 56.9 mtp180 -56.17 -46.77 79.22 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 111.418 0.155 . . . . 0.0 111.418 177.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -63.94 -39.94 95.31 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 123.742 0.651 . . . . 0.0 109.57 179.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . 0.447 HG23 ' O ' ' A' ' 536' ' ' GLY . 97.7 t -60.86 -48.09 90.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.553 179.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . . . . . . . . . 79.5 mt -61.81 -45.47 98.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 CA-C-O 121.07 0.462 . . . . 0.0 110.206 178.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 54.3 m -62.06 -40.37 95.55 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.647 -179.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 44.1 t30 -67.69 -36.77 81.29 Favored 'General case' 0 C--O 1.216 -0.666 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 176.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -62.66 -36.08 81.7 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.27 176.586 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -74.63 -49.29 22.08 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 111.671 0.249 . . . . 0.0 111.671 178.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -73.81 -49.01 27.27 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 68.37 -72.8 0.09 Allowed 'General case' 0 C--O 1.239 0.539 0 C-N-CA 125.117 1.367 . . . . 0.0 111.86 -178.2 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 92.7 m-70 64.72 -80.43 0.03 OUTLIER 'General case' 0 C--N 1.333 -0.133 0 C-N-CA 124.742 1.217 . . . . 0.0 109.897 -172.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 6.5 p80 -157.75 127.98 6.24 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 21.1 p-80 -86.41 81.53 8.29 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-O 122.155 0.978 . . . . 0.0 111.499 -178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 . . . . . 0 C--N 1.299 -1.6 0 CA-C-N 115.033 -0.985 . . . . 0.0 108.603 -179.806 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 393' ' ' MET . . . . . . . . . . . . . 20.3 ptp . . . . . 0 CA--C 1.537 0.466 0 CA-C-O 121.276 0.56 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 394' ' ' SER . . . . . 0.442 ' O ' ' HG ' ' A' ' 399' ' ' LEU . 50.6 m -115.31 2.7 14.06 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 121.365 0.603 . . . . 0.0 110.306 177.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 395' ' ' VAL . . . . . . . . . . . . . 28.3 t -94.93 9.18 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 CA-C-O 122.215 1.007 . . . . 0.0 108.708 -176.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 396' ' ' SER . . . . . . . . . . . . . 12.1 m -63.52 -29.58 70.82 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 114.917 -1.038 . . . . 0.0 112.809 -177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 397' ' ' ASN . . . . . . . . . . . . . 35.1 t30 -171.29 -70.38 0.02 OUTLIER 'General case' 0 CA--C 1.512 -0.511 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 -178.307 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 398' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.76 142.05 47.03 Favored 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 115.006 -0.997 . . . . 0.0 109.578 178.234 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 399' ' ' LEU . . . . . 0.442 ' HG ' ' O ' ' A' ' 394' ' ' SER . 2.4 mp -108.84 119.34 39.25 Favored 'General case' 0 C--N 1.288 -2.071 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 -178.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 400' ' ' LEU . . . . . . . . . . . . . 67.1 tp -69.02 121.46 16.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 108.958 -0.756 . . . . 0.0 108.958 176.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 401' ' ' ALA . . . . . . . . . . . . . . . -120.67 -46.02 2.38 Favored 'General case' 0 N--CA 1.434 -1.26 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -176.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 402' ' ' TRP . . . . . 0.506 ' CZ2' ' HA3' ' A' ' 404' ' ' GLY . 41.7 t90 -150.05 149.23 30.03 Favored 'General case' 0 C--N 1.32 -0.714 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.385 -174.182 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 403' ' ' SER . . . . . . . . . . . . . 10.3 p -133.66 117.71 17.32 Favored 'General case' 0 C--N 1.289 -2.03 0 N-CA-C 107.055 -1.461 . . . . 0.0 107.055 173.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 404' ' ' GLY . . . . . 0.506 ' HA3' ' CZ2' ' A' ' 402' ' ' TRP . . . -158.75 -172.29 25.67 Favored Glycine 0 N--CA 1.425 -2.038 0 C-N-CA 120.19 -1.005 . . . . 0.0 112.306 -173.218 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 405' ' ' VAL . . . . . 0.536 HG12 ' HB2' ' A' ' 426' ' ' SER . 58.2 t -114.98 142.65 27.02 Favored 'Isoleucine or valine' 0 C--N 1.288 -2.067 0 CA-C-O 121.023 0.44 . . . . 0.0 109.924 -175.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 406' ' ' LEU . . . . . . . . . . . . . 89.1 mt -113.05 133.36 55.02 Favored 'General case' 0 C--N 1.31 -1.141 0 N-CA-C 107.604 -1.258 . . . . 0.0 107.604 179.491 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 407' ' ' GLU . . . . . 0.656 ' HG2' HG22 ' A' ' 424' ' ' THR . 38.3 tt0 -116.29 134.41 54.93 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 109.782 -0.451 . . . . 0.0 109.782 -176.743 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 408' ' ' TRP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 450' ' ' MET . 14.4 p-90 -143.22 155.58 44.55 Favored 'General case' 0 C--O 1.252 1.214 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 -173.282 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 409' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -109.53 157.57 18.87 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.236 -1.347 . . . . 0.0 108.696 178.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 410' ' ' GLU . . . . . 0.581 ' HB2' HH21 ' A' ' 425' ' ' ARG . 33.4 tt0 -121.89 -89.88 0.59 Allowed 'General case' 0 CA--C 1.551 1.008 0 N-CA-C 113.787 1.032 . . . . 0.0 113.787 -172.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 411' ' ' LYS . . . . . . . . . . . . . 59.9 mttp -92.69 161.94 30.62 Favored Pre-proline 0 C--O 1.22 -0.492 0 O-C-N 122.122 -0.361 . . . . 0.0 110.05 -175.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 412' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -64.41 -45.58 9.09 Favored 'Trans proline' 0 CA--C 1.542 0.901 0 C-N-CA 121.524 1.482 . . . . 0.0 110.502 173.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 413' ' ' LYS . . . . . 0.41 ' HG2' ' HA ' ' A' ' 419' ' ' ALA . 97.5 mttt -114.91 122.45 33.59 Favored Pre-proline 0 N--CA 1.446 -0.653 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 177.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 414' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -77.81 -56.54 0.04 OUTLIER 'Trans proline' 0 N--CA 1.46 -0.499 0 C-N-CA 122.321 2.014 . . . . 0.0 112.279 -175.6 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 415' ' ' ALA . . . . . . . . . . . . . . . -93.32 1.55 56.92 Favored 'General case' 0 C--N 1.309 -1.16 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.175 -178.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 416' ' ' SER . . . . . . . . . . . . . 19.8 m 71.08 -46.64 0.64 Allowed 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.212 1.405 . . . . 0.0 111.547 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 417' ' ' VAL . . . . . . . . . . . . . 35.2 m -75.15 -16.64 15.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.204 0 CA-C-O 121.639 0.733 . . . . 0.0 109.07 173.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 418' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -99.67 137.27 38.38 Favored 'General case' 0 CA--C 1.501 -0.91 0 N-CA-C 105.773 -1.936 . . . . 0.0 105.773 175.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 419' ' ' ALA . . . . . 0.434 ' HB1' ' CE1' ' A' ' 551' ' ' HIS . . . -88.11 -26.15 22.64 Favored 'General case' 0 C--N 1.299 -1.592 0 N-CA-C 115.137 1.532 . . . . 0.0 115.137 -170.713 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 420' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -128.88 117.42 20.99 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 113.81 1.041 . . . . 0.0 113.81 -171.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 421' ' ' THR . . . . . . . . . . . . . 24.3 m -78.42 85.61 4.51 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 121.454 0.645 . . . . 0.0 109.96 175.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 422' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -100.61 6.08 44.05 Favored 'General case' 0 C--N 1.31 -1.115 0 CA-C-O 121.331 0.586 . . . . 0.0 110.315 176.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -81.38 105.49 12.61 Favored 'General case' 0 N--CA 1.431 -1.423 0 N-CA-C 106.413 -1.699 . . . . 0.0 106.413 174.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' THR . . . . . 0.656 HG22 ' HG2' ' A' ' 407' ' ' GLU . 2.4 m -107.48 116.82 32.62 Favored 'General case' 0 N--CA 1.404 -2.738 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 -179.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' ARG . . . . . 0.581 HH21 ' HB2' ' A' ' 410' ' ' GLU . 0.0 OUTLIER -110.41 157.03 19.99 Favored 'General case' 0 C--N 1.278 -2.501 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.116 -176.97 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' SER . . . . . 0.536 ' HB2' HG12 ' A' ' 405' ' ' VAL . 60.4 p -131.65 159.27 38.81 Favored 'General case' 0 N--CA 1.414 -2.269 0 N-CA-C 112.765 0.654 . . . . 0.0 112.765 -170.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' LEU . . . . . 0.446 HD13 HD11 ' A' ' 483' ' ' LEU . 50.8 mt -127.09 135.32 27.22 Favored Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 123.651 0.78 . . . . 0.0 110.021 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -82.47 132.6 6.92 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.821 2.347 . . . . 0.0 112.208 177.436 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' CYS . . . . . . . . . . . . . 23.7 p -143.71 163.85 32.12 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-O 121.377 0.608 . . . . 0.0 112.212 -177.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' GLN . . . . . . . . . . . . . 45.9 mt-30 -116.77 130.06 56.49 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 106.613 -1.625 . . . . 0.0 106.613 174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' VAL . . . . . . . . . . . . . 43.0 t -117.64 123.78 72.19 Favored 'Isoleucine or valine' 0 C--O 1.268 2.059 0 CA-C-O 122.071 0.938 . . . . 0.0 110.768 -173.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -109.88 158.24 18.39 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.436 179.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 471' ' ' VAL . 33.4 m -121.67 141.52 41.77 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.37 0 N-CA-C 108.111 -1.07 . . . . 0.0 108.111 176.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' ASN . . . . . 0.521 ' HB2' ' CB ' ' A' ' 470' ' ' MET . 11.7 m120 -94.51 130.28 40.98 Favored 'General case' 1 C--O 1.308 4.147 0 N-CA-C 103.3 -2.852 . . . . 0.0 103.3 163.927 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' HIS . . . . . 0.438 ' HB3' ' CD2' ' A' ' 399' ' ' LEU 0.309 31.6 p-80 -63.47 -175.91 0.14 Allowed 'General case' 0 N--CA 1.426 -1.641 0 N-CA-C 118.235 2.68 . . . . 0.0 118.235 -160.919 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' GLY . . . . . . . . . . . . . . . 109.44 -11.25 33.28 Favored Glycine 0 N--CA 1.439 -1.128 0 N-CA-C 105.337 -3.105 . . . . 0.0 105.337 -166.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' GLU . . . . . . . . . . . . . 7.2 tp10 -128.91 149.02 50.96 Favored 'General case' 0 N--CA 1.383 -3.811 0 C-N-CA 127.306 2.242 . . . . 0.0 105.958 177.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' ASN . . . . . . . . . . . . . 53.6 t30 -161.73 102.88 1.18 Allowed 'General case' 0 C--N 1.282 -2.355 0 N-CA-C 105.678 -1.971 . . . . 0.0 105.678 174.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -137.82 151.9 48.57 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 120.218 -0.593 . . . . 0.0 110.647 -176.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' LYS . . . . . . . . . . . . . 49.5 pttt -94.6 123.09 37.83 Favored 'General case' 0 N--CA 1.423 -1.789 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 170.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' THR . . . . . 0.496 HG21 ' HB2' ' A' ' 402' ' ' TRP . 11.7 p -83.45 38.12 0.6 Allowed 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 -170.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -75.64 -23.74 56.37 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 121.89 0.853 . . . . 0.0 109.079 175.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -88.48 -0.78 57.58 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 114.636 -1.165 . . . . 0.0 110.541 -177.166 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' TRP . . . . . . . . . . . . . 16.8 m0 -99.71 131.5 24.58 Favored Pre-proline 0 C--N 1.313 -1.015 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.826 179.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' PRO . . . . . 0.408 ' HG3' ' OG1' ' A' ' 503' ' ' THR . 18.8 Cg_exo -69.18 162.76 40.47 Favored 'Trans proline' 0 N--CA 1.454 -0.802 0 C-N-CA 121.73 1.62 . . . . 0.0 108.965 172.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -80.45 -7.23 59.07 Favored 'General case' 0 C--N 1.313 -0.988 0 O-C-N 122.068 -0.395 . . . . 0.0 110.849 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.446 ' HA ' ' O ' ' A' ' 405' ' ' VAL . 56.4 mtpt -126.97 126.95 44.06 Favored 'General case' 0 N--CA 1.433 -1.297 0 CA-C-N 115.537 -0.756 . . . . 0.0 109.996 179.734 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' LEU . . . . . . . . . . . . . 64.2 mt -113.26 148.46 35.52 Favored 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.881 177.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' ILE . . . . . . . . . . . . . 50.6 mm -97.38 122.8 49.33 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.435 0 CA-C-O 121.051 0.453 . . . . 0.0 109.978 -173.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' MET . . . . . 0.5 ' HB2' ' HB3' ' A' ' 408' ' ' TRP . 79.9 mtp -100.14 118.5 36.61 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.642 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' GLN . . . . . . . . . . . . . 18.8 mt-30 -110.81 113.87 26.79 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 108.782 -0.822 . . . . 0.0 108.782 178.382 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' LEU . . . . . . . . . . . . . 93.1 mt -76.49 127.25 32.47 Favored 'General case' 0 C--N 1.305 -1.339 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.798 -178.347 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 31.3 pt -136.59 161.6 60.98 Favored Pre-proline 0 C--N 1.309 -1.177 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' PRO . . . . . . . . . . . . . 12.2 Cg_exo -71.42 128.85 15.02 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 CA-C-N 120.109 1.075 . . . . 0.0 111.569 178.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -62.97 -26.35 68.8 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 124.164 0.986 . . . . 0.0 110.698 179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -57.48 -38.63 74.83 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 115.016 -0.993 . . . . 0.0 111.649 -178.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 63.9 mt -87.06 -2.06 58.35 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.954 -174.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 6.8 tt -72.78 -24.19 60.9 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 123.302 0.641 . . . . 0.0 111.284 -174.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' THR . . . . . . . . . . . . . 7.5 m -57.03 -31.51 65.23 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.675 0.79 . . . . 0.0 112.045 -174.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' THR . . . . . . . . . . . . . 12.8 m -71.86 -18.04 62.09 Favored 'General case' 0 CA--C 1.561 1.399 0 CA-C-O 121.3 0.571 . . . . 0.0 111.951 -177.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -86.18 0.85 52.68 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.851 -0.531 . . . . 0.0 111.539 -177.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . 0.413 ' N ' ' HD2' ' A' ' 463' ' ' PRO . . . -39.7 -52.32 3.12 Favored Glycine 0 CA--C 1.551 2.288 0 CA-C-N 114.4 -1.273 . . . . 0.0 115.355 178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' PRO . . . . . 0.413 ' HD2' ' N ' ' A' ' 462' ' ' GLY . 6.8 Cg_endo -50.25 -33.17 35.45 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.534 2.823 . . . . 0.0 114.021 178.222 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.64 -38.42 65.02 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-O 121.162 0.506 . . . . 0.0 110.18 -178.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -69.04 -13.62 62.55 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.316 -0.856 . . . . 0.0 111.537 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' ARG . . . . . . . . . . . . . 16.5 mmm180 -68.23 -11.61 59.61 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.568 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -142.17 92.05 2.4 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 122.277 1.037 . . . . 0.0 108.995 171.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 61.7 m -148.14 169.86 19.08 Favored 'General case' 0 N--CA 1.422 -1.868 0 CA-C-O 121.987 0.898 . . . . 0.0 111.922 -176.472 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' ARG . . . . . 0.422 ' HG3' ' HB ' ' A' ' 526' ' ' ILE . 10.7 ptm180 -111.29 142.16 43.88 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 126.739 2.016 . . . . 0.0 107.384 178.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' MET . . . . . 0.521 ' CB ' ' HB2' ' A' ' 434' ' ' ASN . 2.7 mmm -97.62 148.84 22.89 Favored 'General case' 0 CA--C 1.483 -1.628 0 C-N-CA 118.641 -1.224 . . . . 0.0 108.673 -173.464 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.498 HG12 HG12 ' A' ' 433' ' ' VAL . 21.4 m -138.32 151.6 24.91 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 178.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -127.01 128.89 47.06 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 179.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' PHE . . . . . 0.436 ' HB2' ' HB2' ' A' ' 522' ' ' PHE . 22.1 m-85 -107.77 116.54 32.14 Favored 'General case' 0 C--O 1.271 2.226 0 CA-C-O 121.867 0.841 . . . . 0.0 110.419 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' HIS . . . . . . . . . . . . . 23.5 t-80 -123.57 122.57 38.52 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 105.898 -1.889 . . . . 0.0 105.898 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 59.2 m-85 -89.89 157.94 17.66 Favored 'General case' 0 C--N 1.292 -1.919 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 -177.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' THR . . . . . . . . . . . . . 19.1 p -71.99 -74.71 0.15 Allowed 'General case' 0 C--N 1.309 -1.169 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 178.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 84.2 m-20 -91.51 144.17 25.83 Favored 'General case' 0 CA--C 1.444 -3.114 0 N-CA-C 103.729 -2.693 . . . . 0.0 103.729 165.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 483' ' ' LEU . 1.4 mppt? -74.76 -2.16 25.25 Favored 'General case' 0 C--N 1.264 -3.124 0 CA-C-N 115.154 -0.93 . . . . 0.0 108.666 174.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' ASP . . . . . . . . . . . . . 8.5 t70 42.71 68.14 0.53 Allowed 'General case' 0 CA--C 1.46 -2.513 0 C-N-CA 126.875 2.07 . . . . 0.0 107.166 -178.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.434 ' HG ' ' H ' ' A' ' 480' ' ' LEU . 27.4 mt -47.2 -34.03 5.95 Favored 'General case' 0 C--N 1.281 -2.399 0 CA-C-N 109.89 -3.323 . . . . 0.0 115.185 -166.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 17.5 tp10 -72.22 -51.53 20.65 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 118.944 0.793 . . . . 0.0 110.929 174.079 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' SER . . . . . . . . . . . . . 17.9 m -71.27 -47.55 56.28 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -173.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' LEU . . . . . 0.531 ' HB2' ' O ' ' A' ' 478' ' ' LYS . 8.0 mp -73.87 -19.27 60.77 Favored 'General case' 0 C--O 1.193 -1.878 0 C-N-CA 119.362 -0.935 . . . . 0.0 112.389 -177.493 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 59.6 tttm -62.52 -34.43 76.89 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.621 0.724 . . . . 0.0 109.158 175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' GLY . . . . . 0.409 ' O ' HG13 ' A' ' 489' ' ' ILE . . . -69.77 -47.13 50.04 Favored Glycine 0 N--CA 1.438 -1.205 0 CA-C-N 115.181 -0.918 . . . . 0.0 110.872 173.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 65.6 tp -61.72 -39.21 90.71 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.942 0.897 . . . . 0.0 111.729 -178.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' TYR . . . . . 0.467 ' CE1' ' HB3' ' A' ' 483' ' ' LEU . 6.0 m-30 -61.19 -40.36 93.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.631 0.373 . . . . 0.0 110.369 178.36 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' ARG . . . . . . . . . . . . . 78.0 ttt180 -67.13 -38.23 85.2 Favored 'General case' 0 C--O 1.216 -0.692 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.088 177.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 485' ' ' GLY . 64.0 mt -64.19 -49.51 80.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.08 0.466 . . . . 0.0 110.149 178.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' MET . . . . . . . . . . . . . 15.4 mmt -63.85 -35.5 80.83 Favored 'General case' 0 C--N 1.312 -1.032 0 CA-C-O 121.198 0.523 . . . . 0.0 110.946 178.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' GLY . . . . . . . . . . . . . . . -75.29 -14.38 81.97 Favored Glycine 0 CA--C 1.527 0.828 0 CA-C-N 115.947 -0.57 . . . . 0.0 112.078 178.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -84.17 -0.91 53.93 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.585 0.707 . . . . 0.0 109.676 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' GLY . . . . . . . . . . . . . . . 98.89 29.99 6.99 Favored Glycine 0 N--CA 1.44 -1.094 0 C-N-CA 120.491 -0.862 . . . . 0.0 112.861 178.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' PHE . . . . . . . . . . . . . 64.7 m-85 -107.02 161.6 14.59 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-O 120.945 0.403 . . . . 0.0 111.139 176.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ALA . . . . . . . . . . . . . . . -136.28 160.11 39.71 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 177.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' GLY . . . . . . . . . . . . . . . -120.49 106.04 1.13 Allowed Glycine 0 N--CA 1.423 -2.221 0 C-N-CA 119.712 -1.233 . . . . 0.0 111.33 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' CYS . . . . . 0.426 ' SG ' HG21 ' A' ' 537' ' ' ILE . 49.9 t -82.88 123.38 29.33 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 107.067 -1.457 . . . . 0.0 107.067 177.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' VAL . . . . . . . . . . . . . 58.3 t -102.95 120.85 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.131 0 CA-C-O 121.477 0.656 . . . . 0.0 110.165 -176.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' HIS . . . . . . . . . . . . . 34.2 m80 -107.74 143.48 36.2 Favored 'General case' 0 C--N 1.293 -1.888 0 CA-C-N 114.562 -1.199 . . . . 0.0 108.377 176.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -98.68 129.77 29.34 Favored Pre-proline 0 C--N 1.285 -2.211 0 CA-C-N 114.968 -1.014 . . . . 0.0 109.634 -175.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -60.03 162.55 16.17 Favored 'Trans proline' 0 CA--C 1.542 0.907 0 C-N-CA 122.402 2.068 . . . . 0.0 110.845 172.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -77.44 120.79 22.92 Favored 'General case' 0 C--N 1.31 -1.118 0 CA-C-O 121.168 0.509 . . . . 0.0 111.191 -173.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' THR . . . . . 0.408 ' OG1' ' HG3' ' A' ' 445' ' ' PRO . 49.6 m -152.41 -45.89 0.1 Allowed 'General case' 0 C--N 1.308 -1.2 0 N-CA-C 107.574 -1.269 . . . . 0.0 107.574 176.231 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' ALA . . . . . . . . . . . . . . . -63.02 154.75 75.99 Favored Pre-proline 0 CA--C 1.54 0.59 0 CA-C-N 115.365 -0.834 . . . . 0.0 109.196 173.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -55.17 -33.45 84.27 Favored 'Trans proline' 0 N--CA 1.488 1.176 0 C-N-CA 122.91 2.407 . . . . 0.0 113.715 -176.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' CYS . . . . . . . . . . . . . 36.3 t -178.89 -48.33 0.01 OUTLIER 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 107.824 -1.176 . . . . 0.0 107.824 179.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLU . . . . . 0.426 ' HG3' HE22 ' A' ' 530' ' ' GLN . 36.3 tt0 -81.1 104.05 11.32 Favored 'General case' 0 N--CA 1.436 -1.153 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.233 177.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 10.6 p -111.63 -26.62 3.05 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.429 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.436 -179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' ARG . . . . . . . . . . . . . 97.2 mtt180 73.86 149.9 0.1 Allowed 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 124.986 1.314 . . . . 0.0 109.222 -178.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.556 ' O ' ' HD2' ' A' ' 527' ' ' PRO . 27.5 m -122.38 160.15 24.84 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.041 0 C-N-CA 117.326 -1.75 . . . . 0.0 111.883 -174.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.549 ' HB2' HG12 ' A' ' 526' ' ' ILE . 13.5 tp -122.75 142.08 51.1 Favored 'General case' 0 C--N 1.306 -1.304 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -170.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' MET . . . . . . . . . . . . . 43.0 tpp -109.56 114.4 28.0 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.531 HD11 ' HB3' ' A' ' 522' ' ' PHE . 44.8 tp -101.35 123.98 46.3 Favored 'General case' 0 C--N 1.303 -1.456 0 CA-C-O 121.264 0.554 . . . . 0.0 110.037 -178.447 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' LEU . . . . . . . . . . . . . 72.7 mt -126.35 148.87 49.5 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 115.199 -0.909 . . . . 0.0 110.311 -178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -97.96 130.48 44.81 Favored 'General case' 0 C--N 1.273 -2.72 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.301 -178.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' SER . . . . . . . . . . . . . 46.1 t -102.5 109.97 21.77 Favored 'General case' 0 N--CA 1.411 -2.379 0 N-CA-C 107.193 -1.41 . . . . 0.0 107.193 174.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 33.7 p -69.64 -19.81 63.61 Favored 'General case' 0 N--CA 1.443 -0.814 0 CA-C-N 114.793 -1.094 . . . . 0.0 111.531 179.144 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 45.9 mmtm -65.52 -44.32 87.32 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.037 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' LYS . . . . . 0.413 ' HB2' HG13 ' A' ' 521' ' ' ILE . 67.4 mttm -105.85 -9.86 16.97 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.591 -0.732 . . . . 0.0 111.426 -177.109 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 69.14 28.72 4.9 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 124.084 0.954 . . . . 0.0 110.737 -176.509 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' ILE . . . . . 0.413 HG13 ' HB2' ' A' ' 519' ' ' LYS . 2.5 pp -134.62 168.82 22.79 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.835 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.022 -175.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' PHE . . . . . 0.531 ' HB3' HD11 ' A' ' 513' ' ' LEU . 19.2 m-85 -104.67 139.61 39.26 Favored 'General case' 0 C--N 1.306 -1.302 0 C-N-CA 119.678 -0.809 . . . . 0.0 112.203 -172.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' MET . . . . . . . . . . . . . 22.9 mmt -124.17 160.31 28.14 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' GLY . . . . . . . . . . . . . . . -170.89 153.6 21.13 Favored Glycine 0 N--CA 1.416 -2.634 0 C-N-CA 118.805 -1.664 . . . . 0.0 112.823 177.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' LEU . . . . . . . . . . . . . 7.4 mp -114.69 140.02 49.19 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 172.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.549 HG12 ' HB2' ' A' ' 511' ' ' LEU . 21.0 mt -108.21 107.6 60.35 Favored Pre-proline 0 N--CA 1.427 -1.585 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 176.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' PRO . . . . . 0.556 ' HD2' ' O ' ' A' ' 510' ' ' VAL . 33.5 Cg_exo -68.09 133.86 30.05 Favored 'Trans proline' 0 C--O 1.296 3.388 0 C-N-CA 122.441 2.094 . . . . 0.0 112.846 171.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -72.2 -35.2 68.87 Favored 'General case' 0 C--O 1.244 0.802 0 CA-C-N 113.092 -1.867 . . . . 0.0 106.848 174.614 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -73.11 65.73 0.81 Allowed 'General case' 0 CA--C 1.503 -0.838 0 CA-C-N 113.872 -1.513 . . . . 0.0 111.291 177.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' GLN . . . . . 0.426 HE22 ' HG3' ' A' ' 507' ' ' GLU . 4.0 pt20 -66.78 -38.04 85.77 Favored 'General case' 0 C--N 1.29 -2.017 0 CA-C-N 114.504 -1.226 . . . . 0.0 111.59 -177.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' SER . . . . . . . . . . . . . 12.2 m -63.81 -41.6 97.85 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 120.82 0.343 . . . . 0.0 111.144 -177.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' GLY . . . . . . . . . . . . . . . -76.42 -42.9 21.48 Favored Glycine 0 N--CA 1.441 -1.015 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.0 178.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -64.33 -47.47 79.26 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.197 0.199 . . . . 0.0 111.337 -176.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' VAL . . . . . . . . . . . . . 91.1 t -61.97 -39.04 82.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 N-CA-C 109.795 -0.446 . . . . 0.0 109.795 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -63.02 -37.64 87.99 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.368 178.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' GLY . . . . . . . . . . . . . . . -72.41 -47.3 29.2 Favored Glycine 0 N--CA 1.446 -0.699 0 C-N-CA 120.617 -0.801 . . . . 0.0 111.385 176.381 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' ILE . . . . . 0.426 HG21 ' SG ' ' A' ' 497' ' ' CYS . 38.9 mm -62.97 -33.92 63.39 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 C-N-CA 122.963 0.505 . . . . 0.0 111.837 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -56.14 -42.08 76.38 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 122.922 0.489 . . . . 0.0 110.034 179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -66.2 -41.56 90.02 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.811 178.169 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' VAL . . . . . . . . . . . . . 71.7 t -60.89 -44.87 98.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.043 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' ILE . . . . . 0.511 ' O ' ' HG3' ' A' ' 545' ' ' GLU . 90.3 mt -62.4 -45.72 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.395 0 CA-C-N 115.909 -0.587 . . . . 0.0 109.84 178.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' THR . . . . . . . . . . . . . 19.0 m -67.48 -36.54 81.32 Favored 'General case' 0 N--CA 1.431 -1.419 0 CA-C-N 115.747 -0.66 . . . . 0.0 112.412 179.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -66.94 -37.03 83.56 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 177.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' LEU . . . . . . . . . . . . . 57.4 tp -61.56 -41.53 97.52 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.795 174.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' GLU . . . . . 0.511 ' HG3' ' O ' ' A' ' 541' ' ' ILE . 47.2 mt-10 -62.55 -27.97 69.54 Favored 'General case' 0 CA--C 1.537 0.45 0 CA-C-O 121.195 0.521 . . . . 0.0 111.268 178.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' HIS . . . . . . . . . . . . . 83.0 m-70 -83.4 -48.17 10.64 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.279 176.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' HIS . . . . . . . . . . . . . 10.9 t-160 -67.03 -44.45 80.19 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.448 -176.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' HIS . . . . . . . . . . . . . 13.4 m-70 -106.82 99.22 8.81 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-O 120.636 0.255 . . . . 0.0 110.336 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' HIS . . . . . . . . . . . . . 45.2 p-80 -132.58 82.92 2.03 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-O 122.201 1.001 . . . . 0.0 110.032 174.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' HIS . . . . . . . . . . . . . 53.4 m80 -92.61 -17.59 24.16 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 114.648 -1.16 . . . . 0.0 109.04 179.159 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' HIS . . . . . 0.434 ' CE1' ' HB1' ' A' ' 419' ' ' ALA . 21.9 t-80 . . . . . 0 N--CA 1.425 -1.723 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 177.846 . . . . . . . . 1 1 . 1 stop_ save_