data_2haj_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 2haj _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 111.35 0.129 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . 0.459 ' HB3' ' CH2' ' A' ' 522' ' ' TRP . 16.4 mtt180 -86.27 -50.63 6.81 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 120.234 -1.541 . . . . 0.0 109.362 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 16.0 mm -63.15 -52.45 58.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.1 -42.43 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.486 1.039 . . . . 0.0 111.656 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 68.5 mt -72.96 -58.61 4.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 CA-C-N 118.719 0.691 . . . . 0.0 110.264 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.21 -32.65 60.36 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.344 0.973 . . . . 0.0 112.383 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 64.9 mt -69.14 -49.55 55.93 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 117.527 0.663 . . . . 0.0 109.664 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.63 -38.43 75.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.67 0.788 . . . . 0.0 111.346 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.31 -55.43 24.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.069 1.348 . . . . 0.0 109.241 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.06 -20.82 63.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 118.823 -0.608 . . . . 0.0 112.43 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -141.58 80.07 16.5 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.712 1.605 . . . . 0.0 110.369 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.81 -15.34 40.51 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.467 1.445 . . . . 0.0 112.897 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -68.14 -18.94 64.76 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.824 1.193 . . . . 0.0 110.214 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.48 -13.37 39.99 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 121.33 -0.856 . . . . 0.0 110.827 173.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.03 -26.48 68.29 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 118.789 0.722 . . . . 0.0 111.115 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 90.6 m -82.92 -17.48 43.51 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.595 1.089 . . . . 0.0 110.854 174.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.73 -8.34 50.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.112 0.965 . . . . 0.0 111.375 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.47 145.47 35.58 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-N 119.82 1.191 . . . . 0.0 108.488 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.01 170.98 13.17 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.566 2.844 . . . . 0.0 111.484 174.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.09 13.95 0.59 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.467 3.445 . . . . 0.0 113.933 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 9.6 mp 64.05 18.35 11.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.645 1.978 . . . . 0.0 115.935 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -47.1 -42.22 18.66 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.712 1.605 . . . . 0.0 114.78 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.26 6.59 48.63 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.908 0.883 . . . . 0.0 112.633 -175.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 5.2 mp -115.06 -71.83 0.72 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.662 1.585 . . . . 0.0 108.595 -173.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 16.5 t70 59.97 166.9 0.07 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 123.256 1.503 . . . . 0.0 110.118 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.3 -6.19 59.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 119.688 -1.882 . . . . 0.0 110.605 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -81.91 -44.85 16.26 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.72 1.608 . . . . 0.0 112.021 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -76.36 -21.2 56.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 119.072 -0.489 . . . . 0.0 111.662 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 52.9 mt -125.27 96.5 39.17 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-O 118.141 -0.933 . . . . 0.0 108.692 -178.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.46 78.11 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.792 2.995 . . . . 0.0 111.197 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.96 -17.06 2.37 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.875 2.179 . . . . 0.0 113.834 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 11.6 tp -56.24 -27.43 54.96 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.615 2.207 . . . . 0.0 110.231 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.05 -36.77 9.38 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 118.998 -0.89 . . . . 0.0 112.816 174.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -47.44 81.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.752 1.776 . . . . 0.0 110.276 175.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -59.74 -49.99 75.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.376 1.07 . . . . 0.0 110.658 174.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -61.77 -45.88 91.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.439 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -57.46 -52.84 63.77 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -48.66 74.73 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.851 0.46 . . . . 0.0 112.028 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.79 -49.88 81.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -58.06 -46.37 85.52 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.928 1.291 . . . . 0.0 109.942 -175.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.7 m -62.81 -41.51 99.33 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 126.499 1.92 . . . . 0.0 110.785 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 44.3 m -62.14 -45.35 93.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.388 1.449 . . . . 0.0 110.38 176.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -23.91 67.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.983 0.913 . . . . 0.0 112.253 174.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -15.29 53.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.618 1.167 . . . . 0.0 111.535 176.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.9 75.82 66.16 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 124.984 1.314 . . . . 0.0 108.776 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.41 121.39 9.35 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.021 1.814 . . . . 0.0 109.474 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 98.47 8.24 54.97 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.375 0.988 . . . . 0.0 113.421 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.01 152.55 36.57 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.435 1.118 . . . . 0.0 108.027 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' THR . . . . . 0.439 ' HG1' ' HB2' ' A' ' 502' ' ' GLN . 7.3 p -134.03 169.53 17.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.151 0.98 . . . . 0.0 109.031 -174.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -49.88 -48.33 51.47 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.607 1.563 . . . . 0.0 111.509 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -82.94 -41.45 8.69 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -174.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.439 ' HB2' ' HG1' ' A' ' 499' ' ' THR . 51.4 tp60 -63.6 -24.84 67.97 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.449 1.1 . . . . 0.0 111.296 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 68.4 tp -55.58 -50.3 70.45 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.676 1.19 . . . . 0.0 110.451 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.61 -35.06 79.77 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . 0.463 ' OE1' ' HD3' ' A' ' 508' ' ' ARG . 1.0 OUTLIER -70.98 -31.59 68.18 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 117.85 0.295 . . . . 0.0 110.217 178.541 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -70.12 -20.71 63.16 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -112.57 17.22 19.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.034 1.733 . . . . 0.0 109.751 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . 0.463 ' HD3' ' OE1' ' A' ' 505' ' ' GLU . 6.6 tpt180 -55.13 120.36 6.86 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.785 -1.197 . . . . 0.0 109.98 -174.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.43 18.25 78.13 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 118.641 -1.088 . . . . 0.0 113.542 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.519 HG22 ' H ' ' A' ' 512' ' ' ASN . 30.0 m -92.79 150.59 20.53 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.545 1.672 . . . . 0.0 107.998 -175.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -57.72 -20.83 37.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.897 0.856 . . . . 0.0 112.385 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.519 ' H ' HG22 ' A' ' 510' ' ' THR . 11.6 m-20 -93.39 -17.91 22.97 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.819 1.247 . . . . 0.0 109.703 -177.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -54.29 -38.44 65.91 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.208 1.403 . . . . 0.0 110.971 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.1 88.74 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.822 1.192 . . . . 0.0 111.868 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 32.1 m -65.63 -43.16 90.35 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.679 0.792 . . . . 0.0 109.712 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.7 -32.78 74.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.276 0.631 . . . . 0.0 112.09 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.19 -44.52 96.42 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.84 1.656 . . . . 0.0 108.413 174.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.37 -37.38 83.16 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 123.714 0.805 . . . . 0.0 109.899 -177.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.35 -31.04 38.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.89 1.676 . . . . 0.0 114.277 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.4 t -70.33 -53.85 14.99 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 124.989 1.315 . . . . 0.0 110.53 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -71.24 9.73 0.71 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.782 1.633 . . . . 0.0 114.03 175.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . 0.459 ' CH2' ' HB3' ' A' ' 452' ' ' ARG . 0.8 OUTLIER -78.33 85.61 4.45 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.925 1.29 . . . . 0.0 113.512 -173.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -2.63 1.25 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.632 1.973 . . . . 0.0 112.998 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.78 -0.93 10.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.514 1.526 . . . . 0.0 112.503 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -150.17 -63.14 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 127.463 2.305 . . . . 0.0 109.869 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.62 21.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.272 2.629 . . . . 0.0 116.97 173.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -116.75 177.36 4.73 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.5 1.12 . . . . 0.0 110.041 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -135.11 -30.11 1.07 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 126.775 2.03 . . . . 0.0 112.011 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -81.81 -56.28 4.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.319 1.447 . . . . 0.0 109.167 174.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.51 -28.23 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.799 1.24 . . . . 0.0 108.179 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.88 -50.63 65.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.002 0.819 . . . . 0.0 111.718 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.53 -49.95 67.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.829 0.74 . . . . 0.0 109.692 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -48.81 73.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.692 0.797 . . . . 0.0 110.916 177.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.1 m -66.23 -32.42 73.83 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 118.161 -0.923 . . . . 0.0 109.083 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -63.78 -54.1 40.5 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 120.519 1.509 . . . . 0.0 108.906 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 29.8 m -58.89 -45.97 88.97 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.385 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.57 -41.68 98.38 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.974 1.261 . . . . 0.0 112.165 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.6 t -64.21 -49.84 70.42 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.68 1.992 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 3.7 tt -55.51 -50.04 71.01 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 124.65 1.18 . . . . 0.0 108.002 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -55.69 -44.61 77.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.814 0.846 . . . . 0.0 108.812 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -61.84 -44.47 96.76 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.192 0.905 . . . . 0.0 110.538 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -51.26 70.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.326 -0.858 . . . . 0.0 108.736 178.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -59.96 -49.33 78.09 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 123.823 0.849 . . . . 0.0 109.883 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -50.39 -52.11 40.31 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.481 2.312 . . . . 0.0 110.092 177.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -44.19 91.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.547 1.139 . . . . 0.0 112.132 176.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.37 -39.6 92.51 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 120.888 -1.133 . . . . 0.0 111.355 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 23.9 mt -67.49 -38.72 84.76 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.229 1.412 . . . . 0.0 108.891 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.25 -51.19 69.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.621 1.568 . . . . 0.0 109.44 174.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.94 -47.78 81.89 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.91 -45.13 93.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 117.742 -1.123 . . . . 0.0 109.73 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -52.89 56.14 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.393 1.077 . . . . 0.0 109.853 175.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -36.03 82.82 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.166 -177.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -62.03 -43.98 97.68 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 111.491 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.06 -55.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.944 1.298 . . . . 0.0 108.485 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.06 -37.26 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.8 66.87 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 120.084 -1.635 . . . . 0.0 111.659 174.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -96.22 0.01 50.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 116.629 -1.653 . . . . 0.0 112.476 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.59 -44.72 11.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 121.406 1.912 . . . . 0.0 110.617 174.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 1.1 11.74 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.053 1.341 . . . . 0.0 113.471 -173.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.491 ' CG2' ' H ' ' A' ' 561' ' ' HIS . 5.1 t -139.73 -88.74 0.19 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -178.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.491 ' H ' ' CG2' ' A' ' 560' ' ' THR . 0.7 OUTLIER -50.67 -49.64 56.76 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.767 0.827 . . . . 0.0 111.831 -176.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.79 87.79 1.38 Allowed Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 107.341 -2.304 . . . . 0.0 107.341 -175.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 163.27 10.59 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 173.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 32.3 p -67.37 170.13 7.84 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.431 -0.793 . . . . 0.0 111.737 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -64.21 -38.08 89.79 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -64.02 -49.66 71.53 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 124.829 1.252 . . . . 0.0 108.624 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.09 -37.22 84.24 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.816 1.644 . . . . 0.0 110.637 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -30.1 70.13 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.311 1.445 . . . . 0.0 112.541 174.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 13.5 mt -78.86 -38.68 37.27 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-O 117.529 -1.224 . . . . 0.0 109.286 173.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -53.27 -42.35 66.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 119.508 1.049 . . . . 0.0 108.463 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 10.4 mt -53.09 -44.77 67.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.714 1.206 . . . . 0.0 112.736 173.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -52.13 67.01 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 120.113 1.324 . . . . 0.0 109.182 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.41 -45.26 92.0 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.886 0.742 . . . . 0.0 109.861 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.17 -39.16 89.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.998 1.319 . . . . 0.0 111.215 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -65.77 -36.39 83.42 Favored 'General case' 0 C--O 1.227 -0.097 0 C-N-CA 123.864 0.866 . . . . 0.0 109.659 177.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -67.91 -38.46 82.97 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 110.664 176.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.27 -36.42 82.93 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.756 0.822 . . . . 0.0 110.273 176.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.0 mt . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 123.902 0.881 . . . . 0.0 109.762 -177.415 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 122.215 1.007 . . . . 0.0 112.138 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -64.93 -26.41 68.3 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-O 116.066 -1.921 . . . . 0.0 110.112 175.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 15.8 mm -66.6 -52.87 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 O-C-N 125.494 1.746 . . . . 0.0 108.33 174.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.97 -45.25 67.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.662 1.119 . . . . 0.0 111.73 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 41.5 mt -71.55 -60.82 2.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-O 118.128 -0.939 . . . . 0.0 111.337 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -48.6 -43.51 28.67 Favored Glycine 0 C--O 1.227 -0.344 0 C-N-CA 126.088 1.804 . . . . 0.0 112.841 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.25 -42.4 88.63 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 116.282 -1.818 . . . . 0.0 108.525 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.17 -28.62 69.52 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 120.89 1.677 . . . . 0.0 111.502 176.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.66 -55.17 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -81.57 -11.52 59.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.015 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.5 74.76 79.89 Favored Pre-proline 0 N--CA 1.447 -0.591 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -65.01 -18.79 63.05 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 120.979 1.119 . . . . 0.0 112.197 178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.18 -19.71 62.37 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.261 -0.899 . . . . 0.0 111.211 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 17.2 mt -69.79 -13.58 62.35 Favored 'General case' 0 N--CA 1.461 0.075 0 CA-C-N 118.593 0.633 . . . . 0.0 111.169 177.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -61.58 -32.84 72.96 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 117.579 0.172 . . . . 0.0 110.965 174.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.3 m -79.04 -21.17 47.25 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.469 -0.769 . . . . 0.0 111.693 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.75 -19.26 41.73 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 121.513 -0.742 . . . . 0.0 110.297 174.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . 0.436 HG11 ' CG1' ' A' ' 489' ' ' VAL . 2.2 p -64.31 147.57 96.93 Favored Pre-proline 0 N--CA 1.444 -0.749 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -178.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.5 172.77 15.49 Favored 'Trans proline' 0 N--CA 1.434 -1.985 0 C-N-CA 121.492 1.461 . . . . 0.0 109.829 178.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -75.42 4.4 4.98 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 124.172 3.248 . . . . 0.0 112.475 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.9 mp 66.21 68.58 0.44 Allowed 'General case' 0 C--N 1.348 0.537 0 C-N-CA 124.136 0.975 . . . . 0.0 109.132 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.98 -70.53 0.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.92 0.866 . . . . 0.0 110.215 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.64 31.17 5.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.732 0.813 . . . . 0.0 109.375 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.515 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.2 OUTLIER -90.26 -89.15 0.16 Allowed 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -177.364 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.7 t70 64.19 158.44 0.09 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.417 1.58 . . . . 0.0 110.324 -178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . 0.438 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 18.1 mt-10 -81.84 -16.26 51.36 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 120.4 -1.438 . . . . 0.0 109.094 173.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.76 -19.93 66.08 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 123.095 1.426 . . . . 0.0 112.801 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -101.27 -26.04 13.77 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 113.977 -1.465 . . . . 0.0 111.447 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 9.5 mt -142.52 116.11 6.38 Favored Pre-proline 0 N--CA 1.442 -0.832 0 O-C-N 124.127 0.892 . . . . 0.0 110.213 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.1 -44.2 13.15 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.269 1.979 . . . . 0.0 109.791 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -79.15 -20.91 68.81 Favored Glycine 0 C--N 1.339 0.697 0 O-C-N 120.396 -1.44 . . . . 0.0 112.117 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -55.14 -37.2 66.65 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 118.003 0.902 . . . . 0.0 110.203 174.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . 0.438 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -51.17 -47.07 50.63 Favored Glycine 0 C--O 1.221 -0.709 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.33 175.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.06 -51.97 54.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.039 1.42 . . . . 0.0 111.639 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -55.84 -51.9 65.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.812 0.845 . . . . 0.0 110.382 175.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.481 HH21 ' CG ' ' A' ' 490' ' ' ASN . 0.0 OUTLIER -59.88 -46.26 89.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.178 0.591 . . . . 0.0 111.372 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -63.2 -47.83 80.88 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 127.026 2.13 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -46.12 82.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.257 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . 0.436 ' CG1' HG11 ' A' ' 468' ' ' VAL . 72.1 t -63.48 -41.95 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 CA-C-O 117.069 -1.443 . . . . 0.0 108.708 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . 0.481 ' CG ' HH21 ' A' ' 486' ' ' ARG . 27.1 t-20 -54.43 -43.03 71.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 120.95 1.704 . . . . 0.0 110.779 -177.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 17.7 m -70.13 -48.35 57.84 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.803 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 72.7 m -59.46 -36.07 75.28 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 118.993 0.815 . . . . 0.0 111.662 177.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -15.19 26.69 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 128.115 2.566 . . . . 0.0 111.583 174.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.3 t -95.57 -57.74 2.3 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-O 116.59 -1.671 . . . . 0.0 108.087 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -57.91 104.24 0.41 Allowed Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.662 1.585 . . . . 0.0 110.469 -175.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -79.24 122.68 5.28 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 123.01 2.474 . . . . 0.0 111.318 -174.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 67.3 33.15 81.59 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 118.623 -1.751 . . . . 0.0 112.71 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.42 148.49 50.39 Favored 'General case' 0 CA--C 1.506 -0.744 0 O-C-N 120.939 -1.33 . . . . 0.0 111.346 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.1 p -112.05 169.16 9.04 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.96 1.704 . . . . 0.0 110.135 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.6 m -64.66 -35.51 81.26 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.12 -46.9 33.1 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 108.189 -1.964 . . . . 0.0 108.189 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -43.67 55.72 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.48 -173.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 28.5 tp -52.5 -54.89 26.5 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 118.63 0.65 . . . . 0.0 112.218 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.87 -34.84 65.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.941 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.11 -44.24 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 119.467 1.03 . . . . 0.0 112.23 175.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -68.54 -13.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.453 1.501 . . . . 0.0 111.146 176.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . 0.571 ' CD2' ' CD1' ' A' ' 516' ' ' LEU . 37.3 m-85 -118.36 18.56 13.63 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 125.425 1.49 . . . . 0.0 108.728 178.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -58.33 -20.49 43.72 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.795 1.634 . . . . 0.0 112.617 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -137.71 42.48 1.29 Allowed Glycine 0 N--CA 1.438 -1.172 0 C-N-CA 124.454 1.026 . . . . 0.0 111.141 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 51.3 m -105.43 139.57 39.85 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.583 1.191 . . . . 0.0 109.041 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.03 -20.5 17.07 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 119.967 -1.708 . . . . 0.0 113.237 175.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -94.53 -16.91 22.89 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 125.8 1.64 . . . . 0.0 112.173 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.88 -37.31 2.77 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 125.64 1.576 . . . . 0.0 110.589 175.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.79 -60.8 2.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.509 1.524 . . . . 0.0 110.392 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 51.5 m -61.93 -40.75 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.889 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . 0.571 ' CD1' ' CD2' ' A' ' 507' ' ' TYR . 17.4 mt -60.7 -31.34 70.62 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 119.128 0.876 . . . . 0.0 111.171 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.06 -41.53 64.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 122.171 0.986 . . . . 0.0 110.987 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -34.72 78.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.179 174.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 92.1 mt -77.19 -8.86 58.27 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 116.525 -1.702 . . . . 0.0 112.195 174.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.5 t -76.16 -67.67 0.66 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.414 1.886 . . . . 0.0 109.264 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -2.07 8.36 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . 0.426 ' CE3' ' CD1' ' A' ' 525' ' ' ILE . 1.4 t90 -49.37 136.67 15.64 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 123.02 0.528 . . . . 0.0 109.967 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.77 3.24 8.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 124.887 1.275 . . . . 0.0 108.457 -174.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -53.81 -37.78 63.9 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.515 1.15 . . . . 0.0 112.21 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.426 ' CD1' ' CE3' ' A' ' 522' ' ' TRP . 0.0 OUTLIER -93.29 -55.71 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 113.308 -1.769 . . . . 0.0 109.027 179.421 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 45.95 40.07 6.38 Favored 'General case' 0 C--N 1.344 0.343 0 O-C-N 124.612 1.195 . . . . 0.0 110.838 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -159.47 153.21 22.92 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.94 -25.77 10.57 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.722 1.209 . . . . 0.0 111.388 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -82.43 -62.83 1.51 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 124.042 0.937 . . . . 0.0 109.617 177.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 80.1 mt -52.39 -32.89 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -49.11 -58.42 4.99 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.006 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -50.34 -42.52 53.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.411 1.459 . . . . 0.0 113.14 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -51.68 63.15 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.795 176.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 17.0 m -61.72 -28.49 69.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.364 1.466 . . . . 0.0 110.031 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -69.08 -59.75 2.82 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 126.491 1.916 . . . . 0.0 109.816 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 35.3 m -61.18 -39.81 91.54 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 124.028 0.83 . . . . 0.0 109.259 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -56.86 -45.68 82.31 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.27 0.941 . . . . 0.0 110.195 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 3.6 t -65.18 -49.52 69.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.671 0.788 . . . . 0.0 111.461 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . 0.499 HD23 ' CE1' ' A' ' 543' ' ' PHE . 0.4 OUTLIER -55.4 -43.39 75.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.053 177.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.06 -41.21 96.18 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-O 116.166 -1.873 . . . . 0.0 107.46 176.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -68.73 -37.26 79.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 120.782 1.628 . . . . 0.0 109.569 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.8 ttp -62.58 -55.78 24.05 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.817 0.847 . . . . 0.0 110.413 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.515 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 6.3 m-85 -56.06 -45.52 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.367 1.867 . . . . 0.0 110.893 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -59.05 -48.96 79.7 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 126.214 1.806 . . . . 0.0 109.087 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.1 t -56.28 -45.66 80.05 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 6.5 mt -63.16 -46.61 86.37 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.998 -1.064 . . . . 0.0 110.495 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 28.4 mt -60.62 -37.81 82.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.826 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.74 -52.63 35.25 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.632 1.573 . . . . 0.0 109.613 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.28 -45.47 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.309 1.044 . . . . 0.0 108.702 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 35.7 ttt85 -55.15 -54.83 38.32 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.963 175.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.4 -55.31 9.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.207 1.567 . . . . 0.0 109.306 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.56 -38.52 81.34 Favored 'General case' 0 N--CA 1.442 -0.858 0 O-C-N 123.71 0.631 . . . . 0.0 109.982 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.74 -40.17 87.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 119.05 0.841 . . . . 0.0 112.818 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 2.4 mt -66.8 -51.1 59.64 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 38.4 mm -64.9 -38.68 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 CA-C-O 122.976 1.369 . . . . 0.0 110.843 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.42 65.93 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 119.843 -1.786 . . . . 0.0 109.949 174.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -106.26 11.65 30.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 125.51 1.524 . . . . 0.0 110.732 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -98.93 -29.8 12.73 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.994 1.27 . . . . 0.0 110.641 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -22.23 17.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.075 -178.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -96.55 -68.88 0.78 Allowed 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.222 1.487 . . . . 0.0 108.14 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -43.69 18.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.352 178.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 79.68 79.33 0.84 Allowed Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.9 157.65 0.07 Allowed 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 125.563 1.545 . . . . 0.0 110.743 172.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.16 157.95 7.61 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.597 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -53.07 -43.23 66.56 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.466 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.39 -46.74 88.9 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.158 177.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -60.59 -35.43 76.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.3 0.571 . . . . 0.0 111.478 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -37.71 88.53 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.444 -0.785 . . . . 0.0 111.648 175.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.55 -41.07 89.25 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-O 117.454 -1.26 . . . . 0.0 109.024 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -50.91 -38.3 49.18 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.807 0.813 . . . . 0.0 110.966 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 2.0 mt -63.07 -46.59 86.76 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 118.002 -0.999 . . . . 0.0 112.21 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -50.68 52.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.711 1.141 . . . . 0.0 108.981 173.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -33.89 73.5 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -176.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -39.79 64.93 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.65 1.58 . . . . 0.0 111.036 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -56.97 -45.46 82.87 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.905 0.882 . . . . 0.0 108.869 174.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -66.3 -31.63 72.55 Favored 'General case' 0 C--O 1.189 -2.093 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 175.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . 0.265 0.3 OUTLIER -68.87 -23.08 64.17 Favored 'General case' 0 CA--C 1.497 -1.084 0 C-N-CA 129.72 3.208 . . . . 0.0 115.06 174.336 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 -174.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 120.55 0.215 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.62 -30.47 41.43 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.515 -1.707 . . . . 0.0 109.836 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.5 mm -61.98 -42.47 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 119.92 1.236 . . . . 0.0 109.458 175.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . 0.438 ' CD2' ' HE1' ' A' ' 542' ' ' MET . 4.2 mm? -60.85 -52.75 63.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.644 -173.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.5 -50.37 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 C-N-CA 124.665 1.186 . . . . 0.0 108.123 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -53.59 -50.32 53.94 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 126.074 1.797 . . . . 0.0 113.344 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.493 ' CD2' HD12 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -69.48 -47.41 64.01 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.291 -0.955 . . . . 0.0 109.046 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . 0.566 HD11 ' HG ' ' A' ' 492' ' ' CYS . 3.2 tm? -59.83 -33.22 71.47 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.27 -52.32 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 126.149 1.78 . . . . 0.0 108.434 175.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -76.34 -23.61 54.22 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 122.891 0.476 . . . . 0.0 111.97 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -129.76 74.0 81.04 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 124.79 1.236 . . . . 0.0 110.097 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -61.81 -19.5 65.75 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.282 1.988 . . . . 0.0 111.701 -174.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.87 -17.12 63.94 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.946 1.298 . . . . 0.0 111.607 173.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 19.1 mt -63.98 -13.43 46.25 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 120.113 -1.617 . . . . 0.0 109.965 173.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.23 -38.99 92.12 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 88.5 m -71.68 -18.26 62.19 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.001 1.273 . . . . 0.0 112.464 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.1 mt -87.93 -22.13 24.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.578 1.151 . . . . 0.0 112.29 173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -80.08 146.85 64.09 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -75.43 174.23 13.15 Favored 'Trans proline' 0 CA--C 1.553 1.426 0 C-N-CA 122.384 2.056 . . . . 0.0 111.494 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -69.34 4.37 2.05 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 125.115 3.877 . . . . 0.0 114.113 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 5.5 mp 71.76 55.62 0.19 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.647 2.379 . . . . 0.0 112.442 177.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.86 -25.98 44.01 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 -178.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.29 2.08 10.27 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.714 1.206 . . . . 0.0 112.212 -176.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.464 HD22 ' CZ ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -88.38 -75.99 0.41 Allowed 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 126.008 1.723 . . . . 0.0 106.933 -173.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 9.9 t70 63.73 159.03 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 O-C-N 125.452 1.72 . . . . 0.0 112.542 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -93.77 -16.02 24.59 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 119.981 -1.7 . . . . 0.0 110.444 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.69 -22.38 43.49 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.286 2.235 . . . . 0.0 112.383 175.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -16.78 33.22 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 119.081 0.855 . . . . 0.0 111.664 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.44 103.92 6.53 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 123.397 0.679 . . . . 0.0 110.855 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.77 77.84 0.73 Allowed 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.603 3.536 . . . . 0.0 110.004 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.03 -11.08 3.09 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.866 1.698 . . . . 0.0 113.409 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.09 -34.31 78.11 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.434 1.617 . . . . 0.0 109.437 173.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.31 -38.47 12.71 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 119.254 0.933 . . . . 0.0 112.875 175.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -55.05 39.74 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 117.791 0.796 . . . . 0.0 109.581 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -55.99 -47.43 77.72 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.728 0.811 . . . . 0.0 111.29 177.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -49.38 73.74 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.66 -38.76 80.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.738 1.215 . . . . 0.0 111.407 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -49.72 76.68 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 125.688 1.595 . . . . 0.0 110.436 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 69.2 t -60.47 -49.94 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 CA-C-O 117.324 -1.322 . . . . 0.0 107.467 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -51.93 -45.48 64.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.121 1.328 . . . . 0.0 109.784 -175.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.9 m -64.1 -49.46 72.16 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 125.095 1.358 . . . . 0.0 110.45 173.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . 0.566 ' HG ' HD11 ' A' ' 458' ' ' LEU . 98.9 m -58.18 -36.95 73.82 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.478 1.49 . . . . 0.0 113.216 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -21.68 63.93 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 130.044 3.338 . . . . 0.0 112.156 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.9 t -93.41 -61.72 1.51 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 174.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -48.91 91.88 0.04 OUTLIER Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 128.85 2.86 . . . . 0.0 112.206 -173.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -70.66 123.85 10.18 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.336 2.024 . . . . 0.0 111.345 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.07 37.72 94.92 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 22.6 tp -59.37 162.28 4.89 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.786 0.803 . . . . 0.0 110.187 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.75 164.32 29.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.024 1.33 . . . . 0.0 107.555 -176.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.7 m -52.37 -46.16 66.08 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.934 1.294 . . . . 0.0 110.268 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.24 -44.16 23.49 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.83 -26.9 68.98 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.011 0.925 . . . . 0.0 111.142 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 42.2 tp -60.6 -54.33 46.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.14 -32.72 73.35 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.711 0.805 . . . . 0.0 111.159 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.07 -44.31 80.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.574 1.15 . . . . 0.0 111.243 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -63.93 -18.27 64.06 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.245 1.818 . . . . 0.0 112.638 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -113.13 18.57 17.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 127.29 2.236 . . . . 0.0 111.11 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.8 125.07 20.75 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.482 -1.386 . . . . 0.0 109.874 -176.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.65 37.55 61.69 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 44.4 m -108.44 151.48 26.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -61.29 -24.88 66.73 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.846 1.259 . . . . 0.0 110.678 173.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -91.97 -16.91 25.89 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-O 116.979 -1.486 . . . . 0.0 109.909 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.98 -45.79 51.9 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-N 119.567 1.076 . . . . 0.0 108.661 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.47 -46.13 84.04 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 81.4 m -64.16 -47.59 79.27 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 118.504 -0.76 . . . . 0.0 109.244 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.39 -41.16 84.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.698 1.599 . . . . 0.0 110.79 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -41.79 74.43 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 127.155 2.182 . . . . 0.0 109.301 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -62.0 -41.11 97.7 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.373 -1.299 . . . . 0.0 108.533 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 92.8 mt -73.3 -16.55 61.37 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.7 t -70.4 -36.59 74.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.137 1.375 . . . . 0.0 109.6 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.39 2.74 31.56 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.108 1.763 . . . . 0.0 113.406 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -75.7 73.56 2.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.75 1.22 . . . . 0.0 108.693 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.45 -13.12 47.1 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.243 2.617 . . . . 0.0 111.182 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -52.61 -20.06 2.77 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.254 2.622 . . . . 0.0 113.205 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.493 HD12 ' CD2' ' A' ' 457' ' ' LEU . 54.0 mt -51.81 -69.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 128.813 2.845 . . . . 0.0 111.459 175.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -162.7 -94.79 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.77 1.294 . . . . 0.0 110.537 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -152.84 164.56 37.62 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.5 2.72 . . . . 0.0 108.22 -176.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -21.35 64.78 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 120.097 1.317 . . . . 0.0 113.829 174.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.22 -57.42 3.27 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.937 1.695 . . . . 0.0 108.769 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 16.3 mt -71.17 -2.07 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.504 1.522 . . . . 0.0 110.199 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.56 -64.08 0.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.666 1.121 . . . . 0.0 108.258 174.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.47 -35.81 65.91 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.827 0.451 . . . . 0.0 111.285 -176.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -51.19 59.36 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 117.346 -1.311 . . . . 0.0 110.473 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 52.6 m -57.96 -36.7 72.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.615 1.966 . . . . 0.0 110.079 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -62.22 -56.01 22.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.464 -0.779 . . . . 0.0 110.75 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 52.3 m -62.34 -42.52 99.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.089 -0.958 . . . . 0.0 108.944 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.42 -47.26 82.22 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.87 1.268 . . . . 0.0 110.201 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 8.7 t -66.68 -44.53 81.53 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.164 0.986 . . . . 0.0 110.919 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -51.09 68.07 Favored 'General case' 0 C--O 1.202 -1.421 0 C-N-CA 125.157 1.383 . . . . 0.0 108.935 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -60.14 -43.94 95.33 Favored 'General case' 0 C--N 1.372 1.564 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -66.36 -38.52 87.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 120.046 -1.659 . . . . 0.0 111.59 -178.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' MET . . . . . 0.438 ' HE1' ' CD2' ' A' ' 454' ' ' LEU . 0.5 OUTLIER -64.97 -54.91 23.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.464 ' CZ ' HD22 ' A' ' 474' ' ' LEU . 3.0 m-85 -60.43 -47.39 86.31 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.025 1.33 . . . . 0.0 108.1 -175.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -52.23 -51.93 55.4 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.227 2.211 . . . . 0.0 110.377 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.1 t -51.48 -50.57 59.6 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.482 0.713 . . . . 0.0 111.342 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 55.8 mt -66.19 -40.96 90.8 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.722 1.209 . . . . 0.0 111.374 -174.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.06 -38.7 92.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.651 1.981 . . . . 0.0 109.201 174.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -49.96 54.65 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.488 1.515 . . . . 0.0 109.766 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 13.6 mt -58.23 -45.96 86.77 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.291 1.436 . . . . 0.0 109.586 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -59.96 -46.76 88.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.068 0.947 . . . . 0.0 109.648 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -53.84 -47.73 70.65 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.67 -50.07 73.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.396 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -43.63 81.41 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.423 1.889 . . . . 0.0 110.605 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 11.1 mt -59.25 -52.64 64.8 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.696 1.199 . . . . 0.0 109.365 173.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 33.4 mm -63.62 -34.94 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 121.379 1.899 . . . . 0.0 113.1 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -57.64 -37.5 73.45 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -67.96 2.24 2.18 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 128.593 2.757 . . . . 0.0 112.999 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -94.22 -54.4 3.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 119.809 1.186 . . . . 0.0 111.606 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -72.07 8.57 1.22 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.855 1.262 . . . . 0.0 113.451 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.5 p -124.44 -67.4 0.92 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.11 0.964 . . . . 0.0 110.599 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.59 -68.06 0.82 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.695 1.998 . . . . 0.0 109.181 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 140.02 132.07 2.84 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 126.409 1.957 . . . . 0.0 108.544 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.7 120.47 22.68 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.86 172.93 0.48 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.087 0.946 . . . . 0.0 109.712 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.57 -45.99 90.22 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 121.322 -0.861 . . . . 0.0 109.952 172.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.29 -46.15 67.88 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-O 116.998 -1.477 . . . . 0.0 110.319 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -62.63 -42.71 99.75 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 121.116 1.78 . . . . 0.0 110.262 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -59.48 -37.58 78.59 Favored 'General case' 0 C--N 1.343 0.306 0 O-C-N 120.897 -1.127 . . . . 0.0 110.9 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 39.4 mt -73.48 -39.92 64.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.512 176.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -46.54 56.91 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.649 1.58 . . . . 0.0 107.832 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.99 -45.89 78.86 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -47.73 77.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.661 1.119 . . . . 0.0 108.144 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -32.73 73.33 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 118.943 -0.551 . . . . 0.0 111.093 -178.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.74 -37.91 82.81 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.701 1.137 . . . . 0.0 110.347 174.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -71.58 -31.3 66.8 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 120.409 -1.432 . . . . 0.0 109.801 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -73.31 -25.41 60.64 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.608 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -78.04 -35.0 50.24 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.854 1.661 . . . . 0.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 N--CA 1.474 0.731 0 C-N-CA 125.801 1.64 . . . . 0.0 111.911 176.08 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 120.972 0.415 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -59.98 -30.41 69.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.021 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 1.5 mm -63.7 -52.98 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 120.067 1.303 . . . . 0.0 108.162 174.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.87 -52.9 63.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.571 1.078 . . . . 0.0 108.389 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 38.7 mt -66.63 -53.5 34.71 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.082 -176.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -55.6 -41.37 81.67 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 128.19 2.805 . . . . 0.0 112.234 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.3 mt -70.92 -36.03 72.51 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 118.073 -0.965 . . . . 0.0 109.399 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -27.97 67.13 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.259 1.391 . . . . 0.0 111.744 173.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 33.6 t -69.24 -56.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 125.089 1.356 . . . . 0.0 107.908 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -75.9 -8.51 57.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -146.96 70.65 12.21 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 121.198 -0.939 . . . . 0.0 111.706 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.52 -17.85 60.32 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.832 1.688 . . . . 0.0 111.446 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.91 -22.87 64.14 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 120.343 -1.473 . . . . 0.0 112.352 173.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 49.3 mt -59.84 -14.99 17.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.531 1.06 . . . . 0.0 109.907 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.26 -20.57 66.48 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.743 -0.598 . . . . 0.0 112.299 173.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 77.4 m -83.96 -26.19 29.44 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 119.387 0.994 . . . . 0.0 110.254 173.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 28.6 mt -84.98 -14.98 45.81 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.355 -0.84 . . . . 0.0 112.275 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 3.0 p -69.41 152.09 96.56 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -73.74 170.63 19.57 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.063 1.842 . . . . 0.0 111.488 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -74.51 2.28 6.51 Favored 'Trans proline' 0 CA--C 1.541 0.838 1 C-N-CA 125.533 4.155 . . . . 0.0 113.953 173.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 71.09 65.82 0.17 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.92 2.488 . . . . 0.0 110.854 174.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -73.23 -72.98 0.23 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.51 1.124 . . . . 0.0 110.206 -173.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.88 13.72 13.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.665 1.186 . . . . 0.0 112.397 176.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.14 -85.52 0.17 Allowed 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 -173.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.0 t0 62.47 152.13 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 O-C-N 126.384 2.302 . . . . 0.0 111.944 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -84.31 -18.46 36.24 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 118.678 -2.514 . . . . 0.0 108.896 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -78.3 -9.03 59.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.885 1.674 . . . . 0.0 112.95 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -116.74 5.98 13.2 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.569 1.547 . . . . 0.0 111.186 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 163.02 49.02 Favored Pre-proline 0 C--O 1.221 -0.433 0 C-N-CA 126.226 1.81 . . . . 0.0 110.193 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -80.89 -67.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 120.867 1.045 . . . . 0.0 112.991 -172.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -128.03 25.06 4.99 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -62.47 -31.22 71.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.051 -0.976 . . . . 0.0 108.565 172.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.09 -38.28 6.09 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-O 118.644 -1.087 . . . . 0.0 111.696 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -55.55 33.33 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.09 1.945 . . . . 0.0 111.728 174.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -53.69 -54.78 33.05 Favored 'General case' 0 C--N 1.337 0.029 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.721 174.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.2 ttp85 -55.61 -46.18 77.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.535 0.734 . . . . 0.0 110.973 -173.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.59 -39.01 70.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.837 1.255 . . . . 0.0 110.719 -175.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.5 mt -61.16 -46.28 91.16 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 123.282 0.633 . . . . 0.0 109.862 173.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 67.4 t -61.92 -47.85 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-O 118.095 -0.955 . . . . 0.0 108.606 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -54.38 -47.23 72.91 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.616 1.566 . . . . 0.0 109.982 -177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' THR . . . . . 0.412 HG21 HE22 ' A' ' 495' ' ' GLN . 89.5 m -63.96 -47.49 80.2 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 126.07 1.748 . . . . 0.0 109.894 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.2 m -60.74 -36.93 80.13 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.213 -2.18 . . . . 0.0 111.923 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.46 -26.82 68.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.939 2.096 . . . . 0.0 111.55 173.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.78 -53.67 7.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.579 1.552 . . . . 0.0 108.345 173.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.412 HE22 HG21 ' A' ' 491' ' ' THR . 0.4 OUTLIER -64.06 101.06 0.24 Allowed Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 119.645 1.111 . . . . 0.0 111.883 -175.044 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -63.25 128.73 23.44 Favored 'Trans proline' 0 N--CA 1.439 -1.717 0 N-CA-C 107.329 -1.835 . . . . 0.0 107.329 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.63 48.05 56.7 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 124.374 0.988 . . . . 0.0 113.093 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.6 tp -63.61 155.54 29.39 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.149 0.979 . . . . 0.0 110.272 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.0 163.65 29.8 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.568 1.947 . . . . 0.0 108.19 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 86.0 m -51.34 -46.69 62.75 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.182 0.993 . . . . 0.0 110.551 173.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.41 -43.89 14.59 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -62.0 -24.2 66.9 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.778 0.831 . . . . 0.0 111.188 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 24.1 tp -67.09 -51.22 57.04 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 123.876 0.87 . . . . 0.0 110.778 176.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.8 mt -61.18 -34.41 75.01 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 122.76 0.424 . . . . 0.0 110.151 173.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.98 -39.29 90.22 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.466 -0.771 . . . . 0.0 112.318 177.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -65.6 -17.84 64.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.615 1.566 . . . . 0.0 112.577 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -117.26 21.37 13.18 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.99 2.116 . . . . 0.0 110.776 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.18 131.2 50.07 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 119.952 -1.718 . . . . 0.0 109.194 -175.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 67.86 31.08 74.93 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 173.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 53.9 m -102.31 148.69 25.15 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.74 -21.66 64.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.797 1.239 . . . . 0.0 111.362 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.6 -15.75 26.49 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.463 1.505 . . . . 0.0 111.58 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.78 -47.57 59.62 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.77 61.59 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.232 1.013 . . . . 0.0 113.28 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 30.0 m -66.48 -48.74 68.89 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.116 0.966 . . . . 0.0 110.382 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 65.2 mt -57.06 -39.43 74.9 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.351 1.46 . . . . 0.0 111.961 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -75.02 -34.3 61.9 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 127.296 2.238 . . . . 0.0 110.923 -177.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -33.98 75.85 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 173.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.83 -13.87 59.56 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.953 1.251 . . . . 0.0 114.353 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.5 t -72.86 -60.46 2.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.144 1.378 . . . . 0.0 108.739 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -71.1 0.76 6.92 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.646 1.578 . . . . 0.0 113.973 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.96 111.13 3.18 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 124.257 1.023 . . . . 0.0 111.903 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.53 0.25 47.14 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.59 2.356 . . . . 0.0 110.095 -175.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.25 -18.88 60.57 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 125.983 1.713 . . . . 0.0 111.759 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -122.19 -78.58 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 131.26 3.824 . . . . 0.0 109.743 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.3 59.95 4.11 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.151 1.78 . . . . 0.0 111.914 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -153.7 170.78 20.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.853 0.861 . . . . 0.0 110.914 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.22 -32.07 4.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 127.55 2.34 . . . . 0.0 110.911 173.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -84.84 -55.82 3.89 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 120.552 -1.343 . . . . 0.0 109.115 -177.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 63.7 mt -58.05 -27.64 32.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 124.235 1.014 . . . . 0.0 108.56 174.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.91 -59.93 3.62 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 125.168 1.387 . . . . 0.0 109.978 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.28 -42.95 64.16 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.386 0.994 . . . . 0.0 109.75 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -48.65 66.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 89.3 m -61.96 -32.75 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.79 2.036 . . . . 0.0 108.298 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -64.68 -58.71 5.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 125.496 1.519 . . . . 0.0 109.839 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -60.0 -43.82 94.95 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.303 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.45 -43.41 68.05 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 120.878 1.672 . . . . 0.0 109.473 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 2.6 t -71.07 -48.23 53.82 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 176.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -43.91 96.78 Favored 'General case' 0 C--N 1.355 0.833 0 CA-C-O 117.776 -1.107 . . . . 0.0 108.967 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -67.38 -38.44 84.73 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.458 -1.401 . . . . 0.0 111.285 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -54.57 38.25 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -56.39 -48.23 77.31 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.49 1.916 . . . . 0.0 109.783 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.19 -50.48 71.09 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 127.15 2.18 . . . . 0.0 110.134 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.0 t -50.84 -41.28 57.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.002 0.921 . . . . 0.0 111.253 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 6.8 mt -72.85 -41.66 64.55 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 120.504 -1.372 . . . . 0.0 110.596 -176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.56 -45.07 92.89 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 173.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -63.04 -50.78 69.29 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.008 2.123 . . . . 0.0 110.164 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.71 -44.03 77.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.192 1.797 . . . . 0.0 110.08 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -57.35 -46.89 82.86 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.777 -0.63 . . . . 0.0 109.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -55.36 -47.18 76.15 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.661 1.184 . . . . 0.0 110.457 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.44 -39.4 88.87 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -178.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -39.81 93.41 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 124.987 1.315 . . . . 0.0 111.256 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.6 mt -60.56 -55.2 36.19 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 23.1 mm -60.68 -41.26 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 121.068 1.758 . . . . 0.0 111.199 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -62.74 -15.59 53.9 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 119.985 -1.697 . . . . 0.0 113.134 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -98.43 13.79 30.42 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 129.263 3.025 . . . . 0.0 111.028 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -104.25 -61.78 1.4 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 120.502 1.501 . . . . 0.0 109.736 173.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -63.91 -7.75 9.15 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 79.2 p -113.01 -64.4 1.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.065 2.546 . . . . 0.0 109.05 -173.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -93.42 -64.51 1.08 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.102 2.161 . . . . 0.0 111.023 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 134.52 119.95 2.01 Favored Glycine 0 CA--C 1.529 0.961 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 7.1 mt -78.22 131.16 37.03 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.11 171.28 5.79 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.35 -43.89 96.4 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.794 -0.622 . . . . 0.0 110.594 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.49 -54.32 29.97 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.18 -30.53 69.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 O-C-N 119.534 -1.978 . . . . 0.0 115.658 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -68.44 -32.97 73.37 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.641 1.176 . . . . 0.0 109.971 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.42 -38.17 50.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 117.824 -1.084 . . . . 0.0 108.72 174.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.91 -44.22 50.1 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 119.857 1.208 . . . . 0.0 108.256 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.79 -44.55 86.37 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.47 175.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -46.8 79.7 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.421 1.464 . . . . 0.0 108.542 177.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -30.33 70.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -39.86 70.87 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.494 1.518 . . . . 0.0 110.016 173.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -65.11 -38.91 92.23 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.636 1.574 . . . . 0.0 110.887 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -34.35 77.68 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.11 174.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -32.49 63.62 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 128.228 2.611 . . . . 0.0 111.497 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER . . . . . 0 C--O 1.259 1.572 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 -179.269 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 ptt? . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 65.6 mtt-85 -81.69 -48.06 12.17 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 116.363 -1.779 . . . . 0.0 110.881 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . 0.414 HG22 ' CD1' ' A' ' 457' ' ' LEU . 0.5 OUTLIER -57.64 -49.77 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.081 1.309 . . . . 0.0 109.514 -177.182 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.61 -41.97 64.16 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.661 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 96.7 mt -73.52 -53.49 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 119.498 1.044 . . . . 0.0 112.195 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.95 -29.08 72.53 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 119.74 1.155 . . . . 0.0 113.737 -173.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.414 ' CD1' HG22 ' A' ' 453' ' ' ILE . 40.5 mt -70.91 -43.12 68.95 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.571 1.186 . . . . 0.0 108.73 174.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.57 -35.19 77.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.488 1.515 . . . . 0.0 110.765 174.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.28 -47.05 95.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.29 -0.881 . . . . 0.0 110.245 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -83.09 -14.38 53.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.522 0.729 . . . . 0.0 110.822 -174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -145.09 78.6 12.33 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.511 1.924 . . . . 0.0 111.403 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.72 -20.01 64.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 121.019 1.146 . . . . 0.0 113.331 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.56 -15.95 59.45 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.137 1.335 . . . . 0.0 111.109 174.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 45.3 mt -63.4 -15.76 58.52 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 121.022 -1.048 . . . . 0.0 109.942 173.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.72 -25.22 68.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.932 0.787 . . . . 0.0 110.831 173.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 63.4 m -83.54 -17.4 41.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 0.999 . . . . 0.0 111.881 174.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.4 mt -94.34 -5.59 46.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 111.98 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.95 144.81 48.39 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 120.662 1.574 . . . . 0.0 108.691 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.66 164.38 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.586 2.857 . . . . 0.0 111.461 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -67.57 12.87 0.18 Allowed 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 124.232 3.288 . . . . 0.0 114.445 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.319 1.7 mp 80.67 8.34 1.27 Allowed 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 129.207 3.003 . . . . 0.0 115.664 173.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -33.33 -55.2 0.42 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.188 2.995 . . . . 0.0 115.01 -174.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.09 -5.53 21.99 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.757 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 45.6 mt -71.21 -86.29 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.561 1.544 . . . . 0.0 110.887 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . 0.276 24.2 t0 58.96 140.97 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.946 3.298 . . . . 0.0 111.696 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -65.64 -29.91 70.55 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.234 1.814 . . . . 0.0 110.285 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -63.59 -24.2 67.7 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.764 1.165 . . . . 0.0 112.431 174.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -92.43 -17.23 24.86 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 120.934 1.697 . . . . 0.0 112.077 176.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 7.1 mt -128.32 86.32 58.18 Favored Pre-proline 0 CA--C 1.515 -0.378 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.76 90.15 0.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.057 1.838 . . . . 0.0 110.058 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 134.17 -16.18 4.44 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.537 2.018 . . . . 0.0 113.156 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.6 tp -58.19 -24.43 59.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.326 2.063 . . . . 0.0 110.277 173.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.6 -41.49 12.84 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 118.689 0.677 . . . . 0.0 111.875 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -40.79 94.09 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.148 1.474 . . . . 0.0 111.363 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -65.07 -53.03 52.01 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.89 1.276 . . . . 0.0 109.776 173.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -41.56 99.49 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.524 0.73 . . . . 0.0 111.127 -173.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.79 -44.0 82.43 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.815 0.846 . . . . 0.0 109.542 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.4 mt -54.8 -51.46 65.73 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.966 0.506 . . . . 0.0 111.023 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 55.4 t -56.81 -47.65 82.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 125.097 1.359 . . . . 0.0 109.924 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -55.46 -45.08 76.92 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.473 1.509 . . . . 0.0 110.079 179.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.3 m -65.41 -40.19 93.07 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.791 1.636 . . . . 0.0 111.263 174.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.8 m -64.85 -44.27 90.3 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 120.022 1.283 . . . . 0.0 110.397 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.24 -20.67 59.88 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.097 1.359 . . . . 0.0 112.815 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 16.8 t -93.43 -37.42 11.97 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.381 1.872 . . . . 0.0 111.367 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -76.76 105.79 2.75 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.95 1.3 . . . . 0.0 110.065 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.64 115.05 4.2 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.792 1.661 . . . . 0.0 110.94 -173.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.54 36.92 47.75 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.38 155.47 11.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.006 0.922 . . . . 0.0 110.542 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 10.8 p -139.87 174.09 10.87 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.2 m -55.95 -50.04 71.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.644 0.777 . . . . 0.0 109.859 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.08 -43.57 47.95 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -174.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -66.34 -24.52 66.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.347 1.059 . . . . 0.0 110.585 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.47 -52.47 61.24 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 119.609 1.095 . . . . 0.0 109.035 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.83 -38.77 89.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 118.551 -0.738 . . . . 0.0 109.919 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.66 -40.98 98.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.404 0.682 . . . . 0.0 110.709 177.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.59 -20.49 63.64 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.152 -0.968 . . . . 0.0 112.713 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -106.61 14.36 27.09 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.392 1.077 . . . . 0.0 109.004 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -58.59 119.93 7.94 Favored 'General case' 0 CA--C 1.528 0.118 0 O-C-N 119.801 -1.812 . . . . 0.0 111.41 -174.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.9 15.98 66.35 Favored Glycine 0 CA--C 1.527 0.783 0 CA-C-O 119.176 -0.791 . . . . 0.0 113.012 177.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.43 HG23 ' H ' ' A' ' 512' ' ' ASN . 25.3 m -98.17 153.07 18.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -173.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -60.19 -20.35 58.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.225 -0.922 . . . . 0.0 112.039 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.43 ' H ' HG23 ' A' ' 510' ' ' THR . 76.5 m-20 -89.83 -19.31 24.81 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.128 1.771 . . . . 0.0 110.519 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.61 -51.13 58.09 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 124.473 1.109 . . . . 0.0 110.213 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.92 -44.18 60.08 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.942 0.897 . . . . 0.0 112.321 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 53.0 m -62.24 -50.41 71.84 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.884 174.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 21.9 mt -60.09 -39.15 85.12 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.555 1.07 . . . . 0.0 111.534 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.94 -45.79 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.807 2.043 . . . . 0.0 109.381 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -61.42 -29.86 70.2 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.335 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 73.8 mt -88.41 -6.37 57.71 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.782 1.233 . . . . 0.0 112.168 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.9 t -83.24 -50.29 8.56 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 126.46 1.904 . . . . 0.0 109.081 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.92 9.37 6.56 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.879 1.271 . . . . 0.0 113.1 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . 0.448 ' C ' ' H ' ' A' ' 524' ' ' ASP . 5.9 t90 -76.58 78.23 3.26 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.942 1.697 . . . . 0.0 113.448 -172.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.55 -0.78 0.07 Allowed 'General case' 0 CA--C 1.534 0.33 1 C-N-CA 131.797 4.039 . . . . 0.0 113.526 174.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . 0.448 ' H ' ' C ' ' A' ' 522' ' ' TRP . 10.7 t70 -54.7 -26.92 36.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.044 2.138 . . . . 0.0 111.49 174.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.73 -50.69 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 125.84 1.656 . . . . 0.0 110.72 175.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 42.97 47.19 4.9 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.571 1.948 . . . . 0.0 113.306 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.0 173.01 16.57 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 174.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -131.28 -19.96 2.74 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 127.19 2.196 . . . . 0.0 111.809 177.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.88 -56.13 3.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.211 2.204 . . . . 0.0 106.902 173.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 65.2 mt -59.06 -28.33 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.087 0.555 . . . . 0.0 109.75 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.11 -40.15 67.04 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.564 1.145 . . . . 0.0 111.937 176.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -49.97 65.78 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.362 0.983 . . . . 0.0 109.588 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -62.31 -46.57 88.13 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.768 0.427 . . . . 0.0 110.448 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.7 m -66.29 -30.64 71.11 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.604 1.161 . . . . 0.0 110.253 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -69.7 -46.14 66.66 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 119.632 1.106 . . . . 0.0 108.985 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 56.7 m -61.25 -41.08 96.28 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.273 0.488 . . . . 0.0 110.315 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.6 -47.46 86.1 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.997 0.919 . . . . 0.0 111.074 174.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 20.5 t -63.7 -44.9 92.28 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.156 -0.965 . . . . 0.0 111.963 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.02 -50.92 69.56 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.44 -0.79 . . . . 0.0 109.74 175.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -54.77 -44.52 73.77 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.12 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -66.7 -35.57 80.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 119.868 1.213 . . . . 0.0 111.044 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -49.12 71.28 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 174.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -64.18 -47.09 81.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.687 0.676 . . . . 0.0 111.303 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.75 -49.05 69.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.419 2.687 . . . . 0.0 108.53 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 23.2 t -58.68 -42.66 89.02 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.708 -0.62 . . . . 0.0 111.48 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 60.2 mt -71.61 -32.33 67.89 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 119.165 0.893 . . . . 0.0 110.155 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.7 mt -70.85 -41.05 71.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.618 0.767 . . . . 0.0 109.118 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.29 -50.58 71.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.002 0.921 . . . . 0.0 109.184 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 51.7 mt -57.83 -39.06 76.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.206 1.003 . . . . 0.0 110.448 174.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -61.84 -42.94 99.66 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 118.103 -0.951 . . . . 0.0 108.771 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.61 -41.34 97.33 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 116.108 -1.901 . . . . 0.0 110.368 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.37 -46.0 90.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.177 2.262 . . . . 0.0 109.811 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -63.17 -39.09 93.64 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -174.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.58 -51.46 42.33 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.956 1.302 . . . . 0.0 111.388 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.8 mm -64.16 -36.62 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 119.536 1.062 . . . . 0.0 109.123 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.45 -33.61 75.94 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.335 -1.478 . . . . 0.0 111.48 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 52.0 mtt-85 -61.14 -32.43 72.13 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 116.331 -1.795 . . . . 0.0 109.323 173.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -57.22 -42.29 81.08 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 121.402 1.91 . . . . 0.0 110.527 176.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.94 3.65 7.9 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -177.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -148.92 -85.89 0.09 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.417 1.008 . . . . 0.0 108.934 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -47.4 -41.32 19.71 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.994 2.118 . . . . 0.0 113.558 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.8 101.16 1.21 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.15 132.61 54.54 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 173.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 170.58 13.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 122.918 1.342 . . . . 0.0 109.249 176.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -40.02 94.86 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.804 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -46.63 60.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.706 1.879 . . . . 0.0 109.124 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -65.39 -35.27 80.44 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.517 1.053 . . . . 0.0 111.598 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -63.01 -31.75 72.96 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 120.595 -1.315 . . . . 0.0 109.472 174.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 5.0 mp -78.23 -32.3 49.71 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.458 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.49 -43.38 84.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.699 1.59 . . . . 0.0 107.671 173.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.22 -39.84 80.08 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-O 116.481 -1.723 . . . . 0.0 113.269 175.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -62.38 -40.68 97.26 Favored 'General case' 0 C--N 1.345 0.413 0 CA-C-N 122.383 2.356 . . . . 0.0 109.095 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -41.63 76.55 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -40.21 87.6 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.595 -1.315 . . . . 0.0 110.77 174.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -57.93 -42.98 86.0 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.758 1.223 . . . . 0.0 110.331 174.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.43 -27.8 52.36 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.295 1.407 . . . . 0.0 111.375 -176.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.47 -42.29 83.22 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 22.8 mt . . . . . 0 C--O 1.218 -0.593 0 CA-C-N 118.7 0.682 . . . . 0.0 110.887 -178.909 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 17.5 ptt? . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.7 mmm-85 -59.75 -39.68 85.58 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-O 118.179 -0.915 . . . . 0.0 109.61 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 mm -67.98 -43.83 85.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.147 0 CA-C-O 115.146 -2.359 . . . . 0.0 108.873 176.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.05 -54.51 46.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.47 1.941 . . . . 0.0 108.694 -177.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 25.6 mt -59.97 -59.63 3.74 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 124.266 1.026 . . . . 0.0 111.098 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.36 -29.32 71.17 Favored Glycine 0 N--CA 1.468 0.787 0 CA-C-N 120.847 1.658 . . . . 0.0 113.551 -173.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.422 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.1 OUTLIER -71.34 -45.89 61.87 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.457 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.44 -32.12 73.47 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 127.415 2.286 . . . . 0.0 110.83 175.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 18.6 t -66.67 -55.08 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 124.654 1.182 . . . . 0.0 108.201 174.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -72.2 -17.73 61.91 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 118.707 -0.663 . . . . 0.0 112.461 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -146.29 80.62 10.01 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 127.164 2.186 . . . . 0.0 110.68 -174.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.6 -20.92 34.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.207 1.938 . . . . 0.0 112.296 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -66.92 -18.92 65.61 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.929 0.892 . . . . 0.0 110.039 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 43.9 mt -63.85 -12.09 33.27 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.953 1.706 . . . . 0.0 110.179 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.94 87.93 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 119.015 0.825 . . . . 0.0 109.818 173.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 61.3 m -69.21 -13.28 62.32 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.899 0.772 . . . . 0.0 111.967 174.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.71 -15.91 20.16 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.403 1.002 . . . . 0.0 112.573 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . 0.406 HG22 ' CZ ' ' A' ' 485' ' ' PHE . 0.3 OUTLIER -80.26 146.49 62.47 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.87 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -74.33 169.06 23.35 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.829 3.019 . . . . 0.0 112.072 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.83 0.51 5.59 Favored 'Trans proline' 0 CA--C 1.552 1.381 0 C-N-CA 122.703 2.269 . . . . 0.0 114.819 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.286 1.2 mp 76.04 39.92 0.28 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 130.063 3.345 . . . . 0.0 115.816 177.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.68 -51.55 48.33 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.299 1.44 . . . . 0.0 114.108 -178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.72 2.49 19.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.004 -1.685 . . . . 0.0 111.732 174.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.4 -74.29 0.64 Allowed 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 123.375 0.67 . . . . 0.0 111.083 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 5.9 t70 60.06 169.24 0.08 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.928 1.823 . . . . 0.0 110.348 -173.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -84.23 -24.4 30.05 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 125.823 1.649 . . . . 0.0 108.886 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -56.12 -48.43 76.22 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 126.397 1.879 . . . . 0.0 108.609 173.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -74.81 -32.04 61.87 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 119.012 -1.075 . . . . 0.0 111.99 -174.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.09 115.92 16.61 Favored Pre-proline 0 C--O 1.225 -0.214 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -173.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.25 -51.47 0.34 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 CA-C-N 120.67 1.275 . . . . 0.0 111.739 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -67.08 -19.9 70.44 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.862 1.22 . . . . 0.0 112.207 -177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.15 -33.5 73.51 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.567 1.547 . . . . 0.0 110.418 174.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.35 -47.86 6.9 Favored Glycine 0 CA--C 1.527 0.814 0 O-C-N 123.833 0.708 . . . . 0.0 111.844 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -41.35 91.03 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.133 0.973 . . . . 0.0 112.315 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . 0.406 ' CZ ' HG22 ' A' ' 468' ' ' VAL . 41.2 t80 -66.81 -51.17 58.88 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.578 1.535 . . . . 0.0 109.777 174.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -55.63 -47.31 76.82 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 118.449 0.568 . . . . 0.0 111.0 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.48 -39.99 92.59 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.891 0.876 . . . . 0.0 110.792 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.4 mt -64.06 -47.6 79.53 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.85 1.26 . . . . 0.0 112.484 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.4 t -59.0 -49.45 83.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.465 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 174.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -55.33 -44.11 75.59 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.662 1.185 . . . . 0.0 108.944 -176.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 55.0 m -63.01 -43.86 97.59 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.671 2.389 . . . . 0.0 111.837 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.6 m -63.6 -44.06 95.11 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.251 0.932 . . . . 0.0 109.457 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -16.99 64.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.71 1.204 . . . . 0.0 111.229 173.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.68 -16.44 26.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.753 1.221 . . . . 0.0 112.293 176.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -122.26 82.45 45.48 Favored Pre-proline 0 CA--C 1.536 0.427 0 C-N-CA 124.848 1.259 . . . . 0.0 107.796 175.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -63.57 139.38 69.72 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 N-CA-C 108.114 -1.533 . . . . 0.0 108.114 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 78.69 15.45 80.76 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 118.394 -1.225 . . . . 0.0 113.996 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.05 166.4 4.73 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 120.079 1.939 . . . . 0.0 109.183 173.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.7 p -140.93 163.01 34.12 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 119.569 -1.957 . . . . 0.0 108.982 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.4 m -47.63 -41.72 22.68 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.333 1.453 . . . . 0.0 112.469 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -85.02 -50.38 4.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -58.0 -24.19 57.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.007 1.723 . . . . 0.0 112.119 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.6 -48.29 81.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.657 1.117 . . . . 0.0 108.865 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.46 -29.39 68.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.847 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.93 -43.78 78.37 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.615 0.766 . . . . 0.0 109.991 174.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.26 -21.13 61.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.77 1.168 . . . . 0.0 112.868 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -111.53 11.84 21.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.908 0.883 . . . . 0.0 110.163 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.76 126.59 24.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 120.477 -1.39 . . . . 0.0 110.832 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.97 15.39 81.22 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 118.704 -1.053 . . . . 0.0 114.501 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 75.2 m -93.1 148.23 22.18 Favored 'General case' 0 C--O 1.246 0.893 0 CA-C-N 119.222 1.511 . . . . 0.0 108.083 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -58.29 -25.34 61.7 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.172 -0.955 . . . . 0.0 111.134 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.61 -17.94 27.5 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.278 2.231 . . . . 0.0 112.183 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.87 -49.42 62.95 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.917 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.36 -43.79 54.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.338 0.972 . . . . 0.0 112.567 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 78.9 m -60.58 -51.33 69.88 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 76.4 mt -57.13 -44.57 83.45 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 125.541 1.536 . . . . 0.0 112.512 175.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.53 -39.62 88.7 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.641 1.976 . . . . 0.0 109.137 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -37.46 84.71 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 78.7 mt -82.72 -9.53 59.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.641 0.776 . . . . 0.0 112.315 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.8 t -76.24 -59.88 2.57 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 0.0 107.583 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.35 22.58 0.67 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.784 2.034 . . . . 0.0 112.777 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -73.03 114.71 11.49 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.17 7.95 43.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 128.413 2.685 . . . . 0.0 114.595 -173.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -70.89 -40.0 72.48 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.441 -1.412 . . . . 0.0 109.13 173.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.422 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.3 pt -108.38 -70.67 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 127.361 2.264 . . . . 0.0 110.73 -174.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.12 37.79 11.57 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.76 2.024 . . . . 0.0 114.798 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -129.36 -178.74 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.5 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -137.07 -24.68 1.1 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.151 2.18 . . . . 0.0 112.301 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -91.18 -54.79 3.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.007 2.123 . . . . 0.0 108.073 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -62.35 -22.02 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.54 -52.75 63.59 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.279 1.4 . . . . 0.0 111.46 174.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -62.34 -42.21 99.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.301 1.41 . . . . 0.0 110.68 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -53.32 51.91 Favored 'General case' 0 C--N 1.34 0.184 0 O-C-N 122.025 -0.422 . . . . 0.0 111.079 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 33.5 m -61.26 -33.77 74.08 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.236 -1.364 . . . . 0.0 110.664 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -64.23 -49.32 72.42 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 121.242 1.837 . . . . 0.0 109.786 177.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.3 m -62.41 -45.31 93.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.411 1.084 . . . . 0.0 111.159 178.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.87 -43.79 98.13 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.12 1.368 . . . . 0.0 110.694 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 6.0 t -67.56 -45.9 74.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 124.319 1.048 . . . . 0.0 112.616 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.0 tt -54.92 -51.74 65.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -55.52 -44.53 76.75 Favored 'General case' 0 C--O 1.205 -1.245 0 C-N-CA 124.754 1.221 . . . . 0.0 111.327 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -63.3 -38.88 92.9 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.051 0.841 . . . . 0.0 112.053 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.3 -51.42 68.96 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -58.1 -48.35 80.45 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.849 0.86 . . . . 0.0 111.406 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -57.52 -41.44 80.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.721 2.009 . . . . 0.0 109.495 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.5 t -56.73 -36.58 69.89 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.711 -1.243 . . . . 0.0 112.455 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 14.1 mt -81.99 -35.59 28.78 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 124.747 1.219 . . . . 0.0 109.284 -176.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -40.81 91.61 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.218 1.407 . . . . 0.0 108.766 174.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -59.68 -55.68 31.31 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.718 1.607 . . . . 0.0 108.429 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 18.5 mt -52.61 -47.58 66.87 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.491 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -64.36 -44.07 92.57 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.86 1.209 . . . . 0.0 110.128 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.33 -49.29 67.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.154 0.982 . . . . 0.0 108.88 173.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.27 -40.68 86.18 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.176 0.444 . . . . 0.0 110.336 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -54.78 -48.28 72.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.917 1.287 . . . . 0.0 108.969 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 5.1 mt -61.86 -52.73 62.92 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.685 1.594 . . . . 0.0 110.066 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.8 mm -63.69 -35.95 74.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 121.88 2.127 . . . . 0.0 111.239 177.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.88 73.19 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 120.964 -1.085 . . . . 0.0 109.81 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 15.5 mtm180 -92.39 -3.64 54.99 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 116.724 -1.608 . . . . 0.0 111.223 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.47 -60.87 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 122.718 2.508 . . . . 0.0 105.151 173.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -14.52 62.84 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -173.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 62.2 p -114.01 -61.42 1.75 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 120.81 1.641 . . . . 0.0 109.631 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -82.25 -35.79 27.8 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.068 1.347 . . . . 0.0 113.733 -175.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 77.42 80.47 0.66 Allowed Glycine 0 C--N 1.338 0.688 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 -173.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 167.1 1.54 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 173.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 8.4 t -70.19 157.89 36.81 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 120.29 -1.506 . . . . 0.0 108.949 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -38.36 75.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.27 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -63.31 -51.86 64.28 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.322 1.049 . . . . 0.0 111.094 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -53.75 -40.88 66.55 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.534 1.061 . . . . 0.0 111.361 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.93 -39.37 89.19 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.392 -1.443 . . . . 0.0 109.981 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 7.7 mp -72.79 -33.96 66.61 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 116.937 -1.506 . . . . 0.0 110.962 175.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.63 -43.74 62.7 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.446 1.475 . . . . 0.0 108.967 174.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.6 mt -57.06 -39.22 74.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -41.24 92.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 121.442 1.928 . . . . 0.0 108.157 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -35.48 80.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 122.442 0.297 . . . . 0.0 111.369 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.05 -41.35 70.9 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.578 -1.326 . . . . 0.0 109.99 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -60.24 -37.64 81.01 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.992 -1.067 . . . . 0.0 111.246 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -71.54 -32.81 68.56 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.594 1.088 . . . . 0.0 111.019 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -66.74 -40.69 88.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.08 0.952 . . . . 0.0 110.318 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 CA--C 1.549 0.928 0 O-C-N 121.147 -0.97 . . . . 0.0 108.791 -176.902 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -120.53 -42.92 2.52 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.888 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 4.8 mm -68.94 -52.22 36.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.642 0 CA-C-O 117.6 -1.19 . . . . 0.0 108.788 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.1 mt -54.23 -50.17 67.76 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 120.405 1.457 . . . . 0.0 110.595 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.58 -55.6 20.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.163 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.98 -44.1 92.88 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 120.045 1.293 . . . . 0.0 112.815 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.9 mt -65.26 -50.28 66.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.459 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.82 -34.42 74.51 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.963 0.801 . . . . 0.0 111.744 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.64 -48.85 84.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 120.899 -1.125 . . . . 0.0 109.679 175.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -79.12 -17.11 55.67 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.918 -0.489 . . . . 0.0 111.685 175.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -131.42 70.96 81.78 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-N 119.637 1.108 . . . . 0.0 109.198 -176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.85 -18.89 53.06 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.704 1.603 . . . . 0.0 111.576 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -67.45 -23.0 65.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.925 0.89 . . . . 0.0 110.605 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 63.2 mt -62.12 -12.51 19.89 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 120.867 -1.145 . . . . 0.0 110.356 173.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -59.7 -39.79 85.74 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.946 1.248 . . . . 0.0 111.673 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 53.6 m -77.17 -13.96 59.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 120.163 1.347 . . . . 0.0 111.993 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.3 mt -90.73 -19.27 23.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.356 1.063 . . . . 0.0 112.516 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.77 149.21 63.34 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -69.36 173.99 9.81 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.142 3.228 . . . . 0.0 112.08 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -75.06 5.21 4.15 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 124.046 3.164 . . . . 0.0 114.048 175.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 7.1 mp 67.62 53.61 0.7 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.954 2.502 . . . . 0.0 111.675 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.51 -65.66 0.9 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.95 1.3 . . . . 0.0 108.95 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.3 -12.17 60.62 Favored 'General case' 0 C--N 1.344 0.369 0 O-C-N 120.969 -1.082 . . . . 0.0 111.775 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 22.4 mt -82.49 -77.14 0.24 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.2 t0 65.83 150.87 0.05 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.064 1.746 . . . . 0.0 111.999 -174.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.2 -10.01 59.14 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 120.325 -1.484 . . . . 0.0 111.313 178.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -82.09 -37.39 26.41 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.141 0.976 . . . . 0.0 111.102 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -85.23 -29.51 24.6 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 118.508 -0.758 . . . . 0.0 110.414 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -116.16 89.44 25.6 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.475 1.11 . . . . 0.0 109.138 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.9 87.04 0.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.293 3.328 . . . . 0.0 110.146 -176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 135.09 -15.57 4.25 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.767 1.651 . . . . 0.0 112.86 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -25.95 68.34 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-O 116.968 -1.492 . . . . 0.0 110.962 173.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.99 -40.47 12.72 Favored Glycine 0 C--O 1.218 -0.866 0 CA-C-N 119.68 1.127 . . . . 0.0 111.39 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 35.2 tp -61.33 -43.02 99.58 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.82 1.31 . . . . 0.0 112.504 176.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -66.34 -47.59 73.0 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.35 1.06 . . . . 0.0 110.527 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 65.6 ttt-85 -58.73 -51.13 71.28 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.197 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -43.31 99.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 123.83 0.707 . . . . 0.0 110.297 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -49.01 78.08 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 123.56 0.744 . . . . 0.0 111.609 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 71.9 t -62.35 -48.19 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.238 175.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -53.65 -45.76 70.33 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.907 1.683 . . . . 0.0 108.558 -176.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 3.0 m -66.47 -45.73 78.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.401 1.88 . . . . 0.0 110.359 173.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 87.5 m -57.88 -40.3 79.93 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 121.352 1.887 . . . . 0.0 112.065 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.7 -24.5 67.59 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.36 1.464 . . . . 0.0 111.774 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -49.72 12.85 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.363 0.665 . . . . 0.0 110.172 174.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -73.84 102.45 0.62 Allowed Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 124.291 1.036 . . . . 0.0 110.584 -173.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.41 124.35 11.95 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 109.626 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.73 41.98 99.76 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 123.853 0.74 . . . . 0.0 111.379 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 24.9 tp -61.13 156.17 18.84 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.528 0.68 . . . . 0.0 110.083 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.57 165.42 21.75 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.0 m -54.52 -43.25 71.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.448 1.499 . . . . 0.0 110.943 176.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -78.3 -39.14 23.63 Favored Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.42 -26.81 68.14 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.084 0.553 . . . . 0.0 111.849 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 38.2 tp -60.12 -52.68 64.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.11 -31.44 72.64 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 122.053 -0.404 . . . . 0.0 111.745 -179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -44.12 79.14 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.321 1.048 . . . . 0.0 110.442 175.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -61.16 -17.31 52.3 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.833 -1.167 . . . . 0.0 112.714 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -113.73 16.29 18.57 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.785 2.034 . . . . 0.0 110.141 177.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -58.44 133.21 55.57 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 119.837 -1.789 . . . . 0.0 109.149 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 69.93 27.97 72.43 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.038 -0.413 . . . . 0.0 112.581 173.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 53.6 m -108.14 145.91 33.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -61.72 -12.04 14.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.794 1.237 . . . . 0.0 112.062 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -107.55 -14.13 14.91 Favored 'General case' 0 C--N 1.372 1.555 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -48.82 -51.33 30.02 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 120.394 1.452 . . . . 0.0 110.021 172.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.42 -43.26 54.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.374 1.47 . . . . 0.0 113.534 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 17.5 m -64.86 -54.07 36.83 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.1 -34.2 65.8 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 124.278 1.031 . . . . 0.0 111.684 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.37 -39.95 92.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 126.417 1.887 . . . . 0.0 107.853 176.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -63.44 -29.74 70.97 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.126 1.33 . . . . 0.0 112.114 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.84 -41.82 13.74 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 125.954 1.702 . . . . 0.0 110.874 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 14.5 t -61.29 -49.84 75.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.508 1.123 . . . . 0.0 110.323 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -71.9 -7.59 49.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 126.198 1.799 . . . . 0.0 112.729 175.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -72.89 131.21 41.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.46 14.86 7.13 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.062 1.745 . . . . 0.0 109.506 -173.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -61.23 -24.99 66.76 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.042 1.737 . . . . 0.0 110.464 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.1 -59.45 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 128.564 2.746 . . . . 0.0 109.403 175.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.37 30.54 1.58 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.253 2.221 . . . . 0.0 112.656 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -140.41 165.52 27.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.672 1.189 . . . . 0.0 108.847 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -126.52 -30.42 2.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.628 2.371 . . . . 0.0 111.142 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -79.83 -57.03 3.85 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.737 1.615 . . . . 0.0 107.74 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 51.3 mt -59.72 -28.87 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.79 -58.85 6.55 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.869 -1.062 . . . . 0.0 109.426 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.54 -42.72 75.0 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 120.387 1.449 . . . . 0.0 110.777 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -63.6 -55.19 25.66 Favored 'General case' 0 C--O 1.22 -0.456 0 O-C-N 121.85 -0.532 . . . . 0.0 110.303 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 98.3 m -64.02 -26.9 68.77 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.258 1.423 . . . . 0.0 110.239 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -64.42 -59.08 4.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.582 1.083 . . . . 0.0 109.151 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 55.8 m -60.56 -44.92 95.63 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.771 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.05 -44.71 94.48 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.667 1.121 . . . . 0.0 110.777 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 25.7 t -66.16 -49.81 66.11 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.799 2.04 . . . . 0.0 110.556 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.31 -53.6 42.19 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 123.839 0.856 . . . . 0.0 110.76 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.323 1.2 m-20 -64.25 -30.92 71.95 Favored 'General case' 0 N--CA 1.418 -2.045 0 C-N-CA 118.236 -1.385 . . . . 0.0 110.436 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -70.64 -31.56 68.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.148 1.34 . . . . 0.0 110.717 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -55.69 9.53 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -56.39 -48.17 77.43 Favored 'General case' 0 C--N 1.347 0.463 0 C-N-CA 123.727 0.811 . . . . 0.0 109.568 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.5 -46.22 90.92 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.269 2.228 . . . . 0.0 110.655 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 34.9 t -51.56 -45.54 63.1 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.03 -0.419 . . . . 0.0 110.132 174.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 12.0 mt -74.0 -38.95 63.94 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.173 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -47.0 87.11 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.78 -50.54 71.94 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.328 1.451 . . . . 0.0 110.974 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.61 -46.88 87.94 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.296 1.038 . . . . 0.0 109.834 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -64.48 -45.84 85.63 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.518 1.127 . . . . 0.0 109.25 177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.05 -53.31 52.13 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.538 1.135 . . . . 0.0 109.333 175.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -58.61 -43.91 89.78 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 117.445 -1.264 . . . . 0.0 110.097 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -50.14 74.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.723 1.209 . . . . 0.0 110.037 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 2.6 mt -58.37 -53.33 59.53 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.073 1.349 . . . . 0.0 108.527 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.7 mm -65.02 -39.65 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.344 1.058 . . . . 0.0 110.891 -178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.01 -33.11 72.75 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.146 2.178 . . . . 0.0 108.258 176.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.36 -2.27 58.5 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 116.143 -1.884 . . . . 0.0 110.8 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -89.41 -44.81 9.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 122.757 2.526 . . . . 0.0 109.622 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -68.63 -3.34 11.54 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 120.603 -1.311 . . . . 0.0 114.099 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.425 ' CG2' ' H ' ' A' ' 561' ' ' HIS . 0.6 OUTLIER -138.65 -87.98 0.23 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 119.469 1.031 . . . . 0.0 109.071 -175.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.425 ' H ' ' CG2' ' A' ' 560' ' ' THR . 8.6 m-70 -55.77 -27.58 51.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.536 1.934 . . . . 0.0 113.385 -178.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 61.37 83.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 126.499 1.999 . . . . 0.0 109.575 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.53 160.63 0.16 Allowed 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.073 0.949 . . . . 0.0 109.942 173.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.68 163.14 11.95 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.252 -1.379 . . . . 0.0 111.028 -176.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -55.04 -42.23 72.38 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.171 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.95 -50.33 69.06 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 124.806 1.242 . . . . 0.0 110.922 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -56.89 -38.62 73.04 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.174 1.352 . . . . 0.0 111.842 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -38.84 84.08 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.83 -1.169 . . . . 0.0 109.748 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.06 -37.25 85.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.999 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.43 -43.08 75.01 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 124.708 1.203 . . . . 0.0 107.765 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.5 mt -58.39 -41.12 84.16 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.575 1.15 . . . . 0.0 113.692 174.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -46.87 88.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -58.85 -44.51 91.03 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 124.675 1.235 . . . . 0.0 108.462 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -46.73 86.55 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.493 1.517 . . . . 0.0 113.131 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -62.1 -42.44 99.22 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.702 1.601 . . . . 0.0 110.204 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -72.43 -24.17 61.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 117.276 -1.345 . . . . 0.0 112.065 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.21 -37.07 61.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.711 1.205 . . . . 0.0 108.874 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 N--CA 1.477 0.881 0 O-C-N 120.186 -1.571 . . . . 0.0 113.093 176.715 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.0 mtt . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -128.74 -42.08 1.45 Allowed 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 126.988 2.115 . . . . 0.0 108.765 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.4 mm -56.85 -52.41 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.278 0 CA-C-N 119.607 1.094 . . . . 0.0 109.039 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 34.8 mt -53.6 -33.12 53.82 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 82.0 mt -79.43 -54.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 C-N-CA 124.069 0.948 . . . . 0.0 110.208 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.17 -36.97 93.19 Favored Glycine 0 CA--C 1.523 0.546 0 CA-C-N 119.635 1.107 . . . . 0.0 111.692 -174.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -48.42 71.7 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.661 174.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.48 -31.25 69.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.459 1.103 . . . . 0.0 111.451 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.3 t -64.78 -57.78 9.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.314 1.046 . . . . 0.0 108.852 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.35 -32.4 73.99 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.226 -178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -131.48 87.4 46.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 126.069 1.747 . . . . 0.0 109.652 -174.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.33 -17.99 39.24 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.504 1.469 . . . . 0.0 113.23 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -61.28 -22.51 64.92 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.064 1.302 . . . . 0.0 110.731 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.05 -19.14 17.31 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.106 0.962 . . . . 0.0 112.205 174.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.1 -26.04 68.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.737 0.699 . . . . 0.0 112.462 174.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 85.6 m -83.9 -19.85 34.04 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.816 0.847 . . . . 0.0 111.069 174.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 9.6 mt -87.45 -14.75 39.62 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.452 0.701 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.68 140.93 44.25 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.795 1.179 . . . . 0.0 109.749 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.81 164.91 17.45 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.421 2.747 . . . . 0.0 110.817 173.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -65.93 8.95 0.24 Allowed 'Trans proline' 0 CA--C 1.549 1.265 0 C-N-CA 124.871 3.714 . . . . 0.0 115.866 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 90.49 -0.13 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 132.256 4.222 . . . . 0.0 113.535 175.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -34.52 -58.23 0.49 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.611 2.364 . . . . 0.0 115.724 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -98.07 2.76 49.07 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.11 -65.66 0.98 Allowed 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.943 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 24.5 t0 57.88 118.8 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.446 1.898 . . . . 0.0 111.172 -173.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.92 -27.33 65.16 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.296 -1.502 . . . . 0.0 111.285 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -68.93 -23.58 64.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 117.548 -1.215 . . . . 0.0 112.206 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -84.93 -20.02 31.3 Favored 'General case' 0 C--N 1.348 0.529 0 CA-C-N 121.337 1.88 . . . . 0.0 111.393 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 1.2 mt -128.98 91.85 41.46 Favored Pre-proline 0 C--O 1.235 0.318 0 CA-C-N 119.364 0.984 . . . . 0.0 111.309 -173.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.16 85.23 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 124.114 3.209 . . . . 0.0 111.618 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.03 -22.33 2.45 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 125.505 1.526 . . . . 0.0 112.066 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.74 -32.09 68.91 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.963 1.382 . . . . 0.0 110.524 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -53.05 -32.55 42.7 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.301 0.955 . . . . 0.0 113.836 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.25 -44.35 95.42 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 119.584 1.692 . . . . 0.0 110.763 173.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -66.02 -39.6 90.36 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.671 0.789 . . . . 0.0 110.333 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.48 76.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 118.499 0.59 . . . . 0.0 110.255 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.94 -56.56 18.26 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.821 1.648 . . . . 0.0 108.186 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.57 -52.85 53.07 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.212 1.405 . . . . 0.0 111.964 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.41 -42.49 84.29 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 CA-C-N 119.684 1.129 . . . . 0.0 109.931 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.58 -47.95 80.72 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.989 0.813 . . . . 0.0 109.818 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 94.2 m -63.0 -40.45 97.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.732 2.013 . . . . 0.0 110.51 176.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.5 m -64.64 -39.64 94.05 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 120.927 -1.108 . . . . 0.0 110.448 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.76 -16.86 64.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.966 0.906 . . . . 0.0 112.19 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.6 -41.16 12.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.739 1.615 . . . . 0.0 112.194 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -79.33 109.62 12.1 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 120.145 1.339 . . . . 0.0 110.1 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.75 108.96 2.68 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 121.217 1.278 . . . . 0.0 109.661 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.85 54.97 5.57 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.09 0.853 . . . . 0.0 111.705 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.1 165.76 8.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.93 168.31 20.06 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 176.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.4 m -49.24 -51.68 31.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.242 1.417 . . . . 0.0 110.152 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -79.37 -37.12 25.08 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -174.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.47 -31.43 72.58 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.253 0.621 . . . . 0.0 109.995 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 62.6 tp -60.48 -51.97 67.2 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 124.096 0.958 . . . . 0.0 110.349 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.44 -36.08 75.25 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 118.965 -0.54 . . . . 0.0 109.841 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.13 -38.95 75.69 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.318 0.508 . . . . 0.0 110.653 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -69.8 -21.22 63.42 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.663 0.665 . . . . 0.0 112.121 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -105.89 8.65 32.72 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.169 -1.582 . . . . 0.0 109.015 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -54.45 120.66 6.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 119.542 -1.974 . . . . 0.0 111.409 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 88.89 10.2 67.08 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.207 -0.774 . . . . 0.0 113.376 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.466 HG23 ' H ' ' A' ' 512' ' ' ASN . 25.0 m -92.26 152.49 19.79 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.941 1.371 . . . . 0.0 108.028 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.17 -16.25 42.57 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 121.259 -0.901 . . . . 0.0 112.448 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.466 ' H ' HG23 ' A' ' 510' ' ' THR . 61.7 t30 -93.93 -15.12 25.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.133 0.973 . . . . 0.0 111.103 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -53.75 -49.31 68.45 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.079 0.854 . . . . 0.0 110.461 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.89 58.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.739 0.699 . . . . 0.0 112.581 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 90.7 m -66.29 -44.79 82.51 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.894 -0.504 . . . . 0.0 110.285 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.22 -37.59 88.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.425 0.69 . . . . 0.0 111.011 178.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -62.08 -49.34 76.34 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.695 1.998 . . . . 0.0 108.531 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -55.06 -42.04 72.22 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.57 0.748 . . . . 0.0 110.952 174.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 87.7 mt -79.24 -13.56 59.6 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.476 0.71 . . . . 0.0 112.332 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 5.5 t -75.5 -51.64 12.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.19 0.996 . . . . 0.0 108.814 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 1.3 ptm -87.45 33.26 0.69 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 127.14 2.176 . . . . 0.0 111.135 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -88.02 94.92 9.94 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.394 1.092 . . . . 0.0 113.269 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -62.71 -7.8 5.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 128.175 2.59 . . . . 0.0 113.364 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.08 -13.96 62.15 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.564 1.945 . . . . 0.0 112.153 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 2.5 pt -137.87 -60.36 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.234 1.814 . . . . 0.0 110.304 -176.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 53.85 0.86 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.92 3.288 . . . . 0.0 117.822 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . 0.557 ' CG ' ' H ' ' A' ' 528' ' ' LYS . 28.6 t70 -108.47 -173.84 2.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.759 1.163 . . . . 0.0 112.795 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . 0.557 ' H ' ' CG ' ' A' ' 527' ' ' ASP . 0.0 OUTLIER -142.98 -25.84 0.6 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.284 2.634 . . . . 0.0 111.153 -174.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -82.67 -58.69 2.79 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 56.7 mt -55.87 -33.25 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.553 1.141 . . . . 0.0 108.463 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.99 -50.01 67.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.547 1.139 . . . . 0.0 112.531 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.56 -39.29 94.01 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.717 0.77 . . . . 0.0 110.17 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -68.59 -47.1 67.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.701 -0.624 . . . . 0.0 110.245 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 77.5 m -67.24 -27.27 67.08 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 112.154 175.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -65.03 -53.38 46.82 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 173.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 26.0 m -55.8 -44.54 77.9 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 124.44 1.096 . . . . 0.0 109.995 177.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.25 -45.88 82.78 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.9 t -64.89 -44.6 89.11 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.579 -0.7 . . . . 0.0 109.666 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 5.6 tt -56.51 -51.32 68.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.593 1.157 . . . . 0.0 109.776 174.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -61.6 -44.99 95.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.841 -178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.43 -29.71 70.75 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.482 1.913 . . . . 0.0 109.872 175.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.01 -59.91 3.63 Favored 'General case' 0 C--N 1.342 0.243 0 O-C-N 120.735 -1.228 . . . . 0.0 107.787 173.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -59.35 -47.94 83.51 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 124.596 1.159 . . . . 0.0 110.527 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -50.16 -53.95 24.2 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 128.39 2.676 . . . . 0.0 109.479 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 16.7 t -67.3 -36.48 81.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.931 0.332 . . . . 0.0 111.588 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 18.7 mt -65.93 -35.92 81.93 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 119.961 -1.712 . . . . 0.0 110.022 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 32.0 mt -71.65 -38.36 70.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.188 1.395 . . . . 0.0 110.003 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.57 -53.98 51.83 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 108.492 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 65.7 mt -56.73 -46.76 81.14 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.837 1.255 . . . . 0.0 110.223 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -63.72 -36.89 85.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 118.398 -0.81 . . . . 0.0 111.032 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.22 -52.88 63.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.03 -39.06 91.01 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.706 0.685 . . . . 0.0 109.998 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.04 -45.87 91.68 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.5 1.12 . . . . 0.0 111.014 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.321 0.4 OUTLIER -76.24 -34.25 59.2 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.222 -0.924 . . . . 0.0 110.648 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.5 mm -66.52 -34.53 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 119.612 1.096 . . . . 0.0 109.241 173.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.33 82.83 Favored 'General case' 0 CA--C 1.522 -0.102 0 O-C-N 120.424 -1.423 . . . . 0.0 109.892 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -68.64 -5.53 20.69 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.12 176.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 -50.51 11.13 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 121.206 1.821 . . . . 0.0 109.69 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -77.25 14.68 0.87 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.915 1.286 . . . . 0.0 113.916 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -143.28 -81.78 0.19 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.454 -0.779 . . . . 0.0 109.04 176.095 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.445 ' H ' HG22 ' A' ' 560' ' ' THR . 2.3 m170 -61.53 -40.88 96.26 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.079 1.351 . . . . 0.0 112.615 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 95.96 126.64 5.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.979 1.276 . . . . 0.0 111.735 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -73.64 166.01 24.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 173.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 16.3 m -103.53 166.53 10.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.61 -36.24 69.2 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.495 -173.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -76.46 -53.3 8.31 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.32 1.013 . . . . 0.0 109.348 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.43 -26.91 68.95 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.361 0.982 . . . . 0.0 113.199 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -26.33 61.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.384 -1.447 . . . . 0.0 110.274 175.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.2 -27.16 28.21 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.721 1.608 . . . . 0.0 110.373 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -52.05 -41.58 62.42 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 173.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.2 mt -61.04 -37.53 82.93 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.028 -1.463 . . . . 0.0 113.806 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -49.68 76.89 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 121.014 1.734 . . . . 0.0 107.916 174.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.4 m -65.24 -44.99 86.42 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.615 0.572 . . . . 0.0 110.25 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -43.87 80.3 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.459 1.104 . . . . 0.0 110.65 175.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.91 -34.24 77.01 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 121.523 -0.736 . . . . 0.0 110.893 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.38 -37.87 77.76 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.986 0.812 . . . . 0.0 110.392 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -68.3 -32.03 71.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.263 0.483 . . . . 0.0 110.118 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 N--CA 1.466 0.352 0 O-C-N 121.121 -0.987 . . . . 0.0 110.205 176.821 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 4.5 tmm? . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 123.386 1.565 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -127.9 -48.55 1.36 Allowed 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 116.928 -1.511 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.6 mm -61.15 -40.35 85.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.791 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.8 mt -62.31 -52.99 61.47 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 120.294 1.406 . . . . 0.0 109.907 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 73.5 mt -70.33 -55.33 14.91 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 117.787 -1.102 . . . . 0.0 110.86 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -49.22 -55.71 11.93 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' A' ' 457' ' ' LEU . 0.7 OUTLIER -50.97 -46.68 61.34 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 117.175 -1.393 . . . . 0.0 113.412 174.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . 0.601 ' CD1' ' HG ' ' A' ' 492' ' ' CYS . 2.3 tm? -61.95 -29.97 70.6 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 124.306 1.004 . . . . 0.0 111.345 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 22.2 t -67.81 -54.77 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 124.446 1.099 . . . . 0.0 109.126 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -74.6 -11.47 60.21 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.778 -0.576 . . . . 0.0 112.068 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -142.33 78.05 17.04 Favored Pre-proline 0 N--CA 1.445 -0.71 0 CA-C-N 118.513 0.597 . . . . 0.0 110.297 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -65.57 -20.15 60.27 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 121.518 1.479 . . . . 0.0 111.206 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.55 -25.54 64.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.973 1.309 . . . . 0.0 111.509 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.81 -15.09 38.9 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-N 119.285 0.948 . . . . 0.0 110.155 173.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.44 94.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.219 -0.925 . . . . 0.0 110.039 173.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 83.4 m -72.88 -17.93 61.47 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.882 -1.136 . . . . 0.0 111.348 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 3.5 mt -84.99 -27.68 26.29 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.267 1.027 . . . . 0.0 109.665 175.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.8 144.98 89.19 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -69.86 168.55 21.37 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.165 1.91 . . . . 0.0 111.012 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -71.17 1.12 5.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.878 3.052 . . . . 0.0 114.004 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.2 mp 72.95 58.76 0.11 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 129.396 3.079 . . . . 0.0 109.338 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.02 -37.08 29.74 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.322 -0.861 . . . . 0.0 110.938 -173.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.1 17.42 21.66 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 125.295 1.438 . . . . 0.0 112.291 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.44 ' HG ' ' CZ ' ' A' ' 543' ' ' PHE . 15.2 mt -106.41 -94.9 0.36 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.232 -1.366 . . . . 0.0 109.004 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 46.6 t0 78.92 142.99 0.08 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.376 2.271 . . . . 0.0 109.83 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.93 -19.37 62.59 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.135 -0.978 . . . . 0.0 109.805 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -59.92 -43.17 95.08 Favored 'General case' 0 C--N 1.341 0.212 0 O-C-N 121.078 -1.013 . . . . 0.0 110.07 174.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -32.58 43.97 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 118.878 -0.582 . . . . 0.0 110.42 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 60.4 mt -131.9 96.2 20.85 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 125.839 1.655 . . . . 0.0 108.821 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.28 1.95 3.68 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 123.428 2.752 . . . . 0.0 113.165 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -109.36 -13.53 16.95 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 120.99 -1.069 . . . . 0.0 111.838 174.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 5.6 tt -61.06 -35.43 76.92 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 116.687 -1.625 . . . . 0.0 108.816 174.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -41.95 -46.56 5.09 Favored Glycine 0 N--CA 1.479 1.536 0 CA-C-N 119.746 1.157 . . . . 0.0 111.553 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -49.12 78.8 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.581 0.752 . . . . 0.0 110.709 177.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -59.8 -46.11 90.24 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.243 1.017 . . . . 0.0 111.274 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -49.69 76.05 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 117.611 -1.185 . . . . 0.0 107.994 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.64 -39.65 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.996 0.918 . . . . 0.0 110.601 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -54.1 50.8 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.833 1.253 . . . . 0.0 111.329 174.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 88.8 t -60.04 -46.1 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 116.773 -1.584 . . . . 0.0 108.288 175.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -54.9 -50.06 69.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.377 1.871 . . . . 0.0 109.028 -175.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.6 m -58.0 -50.65 72.68 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.74 173.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . 0.601 ' HG ' ' CD1' ' A' ' 458' ' ' LEU . 90.1 m -61.2 -36.86 81.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.685 1.584 . . . . 0.0 112.75 -178.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -21.41 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 128.562 2.745 . . . . 0.0 110.974 173.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.32 -58.79 1.98 Allowed 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 117.658 -1.163 . . . . 0.0 108.669 173.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -46.24 93.06 0.05 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 128.345 2.658 . . . . 0.0 112.148 -173.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -73.16 119.84 6.25 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.653 2.235 . . . . 0.0 110.643 -173.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 66.32 36.99 92.44 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.7 160.94 10.76 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-O 121.216 0.531 . . . . 0.0 110.139 175.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.97 165.83 24.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 90.3 m -53.68 -41.64 67.1 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.381 1.473 . . . . 0.0 109.825 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.06 -40.81 11.01 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -62.74 -29.43 70.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.052 0.541 . . . . 0.0 111.552 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.09 -53.73 53.39 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.86 -37.3 71.11 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.38 0.536 . . . . 0.0 111.578 176.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.04 -40.53 87.18 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.163 -0.336 . . . . 0.0 111.085 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -66.72 -15.71 63.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.777 1.231 . . . . 0.0 111.917 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -116.87 16.23 15.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.906 1.682 . . . . 0.0 109.158 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -56.98 131.8 50.9 Favored 'General case' 0 C--N 1.34 0.172 0 O-C-N 120.465 -1.397 . . . . 0.0 108.936 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.62 74.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-O 119.683 -0.51 . . . . 0.0 112.456 173.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 32.2 m -110.41 147.68 33.52 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.602 1.161 . . . . 0.0 108.485 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -61.09 -22.1 64.3 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 111.424 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -92.26 -16.95 25.46 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 124.884 1.274 . . . . 0.0 109.775 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.55 68.03 Favored 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.58 -45.83 63.26 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.899 0.88 . . . . 0.0 112.589 178.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 52.9 m -66.27 -43.99 84.87 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.866 -0.521 . . . . 0.0 109.843 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 50.3 mt -61.73 -38.39 87.77 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.818 1.247 . . . . 0.0 111.808 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -71.07 -41.02 71.25 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 127.314 2.246 . . . . 0.0 109.399 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -61.38 -38.44 87.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 86.7 mt -78.55 -11.53 59.97 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.694 -0.669 . . . . 0.0 112.634 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 22.7 t -79.75 -55.69 4.82 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 119.186 0.903 . . . . 0.0 108.769 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -74.01 5.99 3.79 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.279 1.431 . . . . 0.0 113.256 176.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -61.56 126.35 27.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.628 -0.67 . . . . 0.0 110.362 -173.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -110.82 6.22 21.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.908 2.083 . . . . 0.0 109.823 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.59 -30.57 70.88 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.558 -1.339 . . . . 0.0 109.958 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.424 ' CD1' HD22 ' A' ' 457' ' ' LEU . 1.1 pt -113.31 -77.91 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 129.148 2.979 . . . . 0.0 110.824 -174.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.7 57.75 5.65 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.286 1.434 . . . . 0.0 111.295 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -145.84 179.47 7.43 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.519 -0.738 . . . . 0.0 110.183 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -128.48 -37.88 1.78 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.444 2.297 . . . . 0.0 110.545 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -79.32 -59.74 2.64 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.096 1.758 . . . . 0.0 108.962 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 32.1 mt -60.23 -24.77 31.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-O 117.852 -1.071 . . . . 0.0 108.253 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.6 -66.75 0.34 Allowed 'General case' 0 C--N 1.347 0.473 0 C-N-CA 125.012 1.325 . . . . 0.0 110.199 176.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -45.83 63.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.184 0.594 . . . . 0.0 110.274 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -62.65 -50.88 69.47 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.573 -176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.7 m -61.01 -34.43 74.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 126.331 1.852 . . . . 0.0 110.867 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -63.1 -57.23 11.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.204 0.911 . . . . 0.0 109.593 178.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 43.8 m -60.0 -42.2 93.75 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.982 -1.009 . . . . 0.0 109.4 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -54.85 -47.11 74.58 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.483 1.513 . . . . 0.0 110.354 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.3 t -62.67 -56.19 19.98 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.851 1.66 . . . . 0.0 109.901 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.63 -57.26 6.5 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.805 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -54.76 -44.24 73.45 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 126.826 2.05 . . . . 0.0 109.801 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -60.75 -44.04 97.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.473 1.109 . . . . 0.0 111.621 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -56.97 11.65 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.44 ' CZ ' ' HG ' ' A' ' 474' ' ' LEU . 27.1 m-85 -56.64 -48.51 77.37 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.417 0.448 . . . . 0.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -51.28 -53.98 30.45 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.328 1.851 . . . . 0.0 110.734 175.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 43.8 t -53.92 -44.42 70.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.95 -43.36 83.35 Favored 'General case' 0 C--O 1.225 -0.215 0 O-C-N 120.72 -1.238 . . . . 0.0 109.275 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.09 -48.52 78.4 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.405 1.482 . . . . 0.0 109.572 174.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.04 -54.4 42.0 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.425 1.09 . . . . 0.0 110.214 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 20.2 mt -54.7 -38.33 66.91 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 123.63 0.772 . . . . 0.0 109.558 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -65.37 -52.94 50.24 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -53.8 -51.05 64.73 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.517 1.127 . . . . 0.0 108.054 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.87 -41.1 99.26 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.027 -176.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -52.81 62.55 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 127.141 2.177 . . . . 0.0 109.863 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -51.3 70.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.852 1.261 . . . . 0.0 108.835 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.88 -37.31 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.729 -1.232 . . . . 0.0 110.217 175.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.25 -10.13 56.35 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 126.268 1.827 . . . . 0.0 111.057 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -96.75 9.45 41.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 116.704 -1.617 . . . . 0.0 109.642 173.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -100.57 -46.67 5.12 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.53 1.968 . . . . 0.0 111.198 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.13 -16.28 63.94 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.883 -1.136 . . . . 0.0 112.595 179.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 1.5 t -113.38 -105.33 0.39 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -44.15 -56.03 4.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 128.234 2.614 . . . . 0.0 113.159 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 116.98 133.05 4.98 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 128.318 2.866 . . . . 0.0 108.303 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.2 mt -78.41 -171.27 2.36 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.9 m -137.19 171.83 13.9 Favored 'General case' 0 CA--C 1.498 -1.022 0 O-C-N 119.458 -2.026 . . . . 0.0 110.324 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.24 -48.18 74.31 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 113.248 -1.796 . . . . 0.0 109.05 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -72.91 -48.89 33.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.371 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -56.16 -43.34 78.26 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.147 0.579 . . . . 0.0 110.293 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -60.76 -37.57 82.3 Favored 'General case' 0 C--N 1.346 0.425 0 O-C-N 121.14 -0.975 . . . . 0.0 111.251 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.99 -33.46 61.84 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 122.836 0.455 . . . . 0.0 109.916 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -60.91 -40.71 94.2 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 120.443 -1.41 . . . . 0.0 107.586 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.84 -41.98 92.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 116.654 -1.641 . . . . 0.0 110.475 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -51.41 67.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.261 1.846 . . . . 0.0 106.974 177.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -59.55 -38.17 80.36 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 125.554 1.784 . . . . 0.0 109.123 -173.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.18 -52.69 57.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.396 1.478 . . . . 0.0 111.46 176.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -61.03 -45.75 93.51 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.54 1.936 . . . . 0.0 110.804 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -67.43 -26.37 66.38 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 118.143 -0.932 . . . . 0.0 110.365 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -32.38 73.84 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.569 1.148 . . . . 0.0 110.559 173.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 179.252 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.6 ptt? . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -61.29 -31.95 71.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.39 -2.243 . . . . 0.0 111.662 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 13.1 mm -63.23 -52.41 58.99 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 121.124 1.783 . . . . 0.0 108.791 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 10.7 mt -53.13 -50.38 64.62 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.522 1.055 . . . . 0.0 110.432 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 25.4 mt -59.0 -59.71 3.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.329 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.82 99.45 Favored Glycine 0 C--O 1.223 -0.535 0 CA-C-N 119.939 1.245 . . . . 0.0 112.54 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.457 ' CD2' HD13 ' A' ' 525' ' ' ILE . 1.0 OUTLIER -61.48 -43.51 98.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.565 -0.962 . . . . 0.0 108.619 177.095 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.79 -35.75 81.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.947 1.299 . . . . 0.0 111.373 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 75.2 t -59.9 -56.3 18.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 O-C-N 120.994 -1.066 . . . . 0.0 108.3 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -75.39 -9.92 58.99 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.981 -0.45 . . . . 0.0 111.944 -177.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.14 73.25 12.08 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 125.125 1.37 . . . . 0.0 109.894 -177.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.74 -19.99 59.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.782 2.321 . . . . 0.0 112.668 -174.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.29 -21.82 64.29 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.978 1.711 . . . . 0.0 110.153 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.45 HD12 ' CG ' ' A' ' 535' ' ' PHE . 76.5 mt -63.82 -13.51 45.1 Favored 'General case' 0 C--N 1.351 0.644 0 O-C-N 120.441 -1.412 . . . . 0.0 110.513 173.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.38 -32.64 74.37 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.122 0.874 . . . . 0.0 110.243 173.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.1 m -77.75 -17.35 57.64 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.783 -1.198 . . . . 0.0 110.943 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.79 -11.92 38.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 117.605 -1.188 . . . . 0.0 112.244 174.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 2.4 p -94.5 151.28 39.18 Favored Pre-proline 0 CA--C 1.542 0.671 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -72.77 177.72 7.26 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.42 2.747 . . . . 0.0 112.519 175.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.9 5.22 3.58 Favored 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.421 2.747 . . . . 0.0 114.643 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.254 1.8 mm? 71.18 47.81 0.39 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 129.342 3.057 . . . . 0.0 114.291 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -87.95 -20.09 26.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -173.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -106.05 -3.08 22.0 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.448 -1.407 . . . . 0.0 111.895 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 3.5 mp -109.1 -78.53 0.59 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 125.511 1.525 . . . . 0.0 108.508 -173.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 11.0 t70 62.61 162.73 0.09 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.121 1.768 . . . . 0.0 110.987 -173.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.8 -21.79 60.93 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.429 -1.419 . . . . 0.0 108.755 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -51.74 -43.29 62.84 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.159 2.584 . . . . 0.0 110.032 173.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -84.09 -49.7 8.65 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.477 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 13.0 mt -114.28 102.22 54.67 Favored Pre-proline 0 N--CA 1.47 0.556 0 C-N-CA 123.588 0.755 . . . . 0.0 112.034 -173.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.21 -26.03 15.18 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.56 2.174 . . . . 0.0 111.422 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -85.91 -15.98 64.19 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.646 -1.086 . . . . 0.0 112.656 174.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -25.55 65.22 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 119.021 1.41 . . . . 0.0 108.806 173.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.66 -48.35 7.38 Favored Glycine 0 C--O 1.218 -0.895 0 CA-C-N 119.85 1.205 . . . . 0.0 111.146 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -46.81 87.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.154 0.977 . . . . 0.0 110.677 176.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -59.74 -49.37 78.01 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.596 -0.69 . . . . 0.0 110.846 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -64.66 -44.85 89.1 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 124.881 1.272 . . . . 0.0 110.028 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.37 -49.45 76.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.753 1.221 . . . . 0.0 108.131 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.15 -51.33 70.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.342 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.6 t -56.69 -46.79 83.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 124.656 1.182 . . . . 0.0 109.935 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -58.32 -46.76 85.57 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.019 1.327 . . . . 0.0 108.587 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 18.1 m -64.53 -39.68 94.21 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 124.188 0.995 . . . . 0.0 110.364 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 81.1 m -62.99 -41.96 99.71 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 120.777 1.626 . . . . 0.0 110.775 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.57 -22.84 67.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.667 1.587 . . . . 0.0 111.355 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.1 t -85.25 -50.44 7.36 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.752 0.821 . . . . 0.0 110.206 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -67.6 104.44 0.66 Allowed Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.3 1.84 . . . . 0.0 110.424 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -68.09 122.55 9.64 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.097 1.865 . . . . 0.0 110.018 -174.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.12 40.4 99.14 Favored Glycine 0 C--N 1.34 0.764 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.35 155.64 8.82 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.255 1.026 . . . . 0.0 110.662 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' THR . . . . . 0.438 ' HG1' ' CB ' ' A' ' 502' ' ' GLN . 2.4 p -143.0 163.36 32.99 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 37.4 m -50.41 -48.58 56.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.653 1.981 . . . . 0.0 110.431 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.6 17.36 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.438 ' CB ' ' HG1' ' A' ' 499' ' ' THR . 50.8 tp60 -59.89 -24.41 64.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.757 1.223 . . . . 0.0 111.569 176.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.66 -49.45 76.47 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 119.666 1.121 . . . . 0.0 110.097 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 -33.58 76.13 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.883 -0.579 . . . . 0.0 111.818 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -68.87 -45.78 70.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.734 0.814 . . . . 0.0 108.836 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -63.59 -17.17 62.58 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.952 -1.093 . . . . 0.0 113.04 174.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -110.81 13.6 22.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.315 1.446 . . . . 0.0 109.1 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -56.19 129.45 40.22 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 119.576 -1.952 . . . . 0.0 109.133 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 78.64 8.2 87.79 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 118.979 -0.901 . . . . 0.0 113.967 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 52.6 m -92.5 146.85 23.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.058 1.429 . . . . 0.0 108.412 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -19.64 54.76 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 121.174 -0.954 . . . . 0.0 111.043 176.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -94.22 -18.68 21.45 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.492 1.917 . . . . 0.0 111.508 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.96 -40.75 44.81 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.538 1.135 . . . . 0.0 110.608 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.61 66.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.461 2.304 . . . . 0.0 110.081 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 6.8 m -58.51 -54.16 50.21 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 117.061 -1.447 . . . . 0.0 107.285 176.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.95 -42.49 68.93 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.76 1.164 . . . . 0.0 110.878 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.58 -46.71 87.1 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.304 1.842 . . . . 0.0 111.405 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -32.51 72.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.471 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 31.4 mt -76.44 -22.74 54.24 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.169 174.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.1 t -65.17 -58.8 5.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 121.334 1.879 . . . . 0.0 111.824 -178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.99 1.38 5.73 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.479 1.511 . . . . 0.0 113.517 175.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -71.46 86.15 0.85 Allowed 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.428 1.091 . . . . 0.0 109.591 -173.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.19 -12.7 19.36 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.719 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.63 -13.65 0.7 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 128.028 2.531 . . . . 0.0 114.159 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.457 HD13 ' CD2' ' A' ' 457' ' ' LEU . 4.3 mt -57.61 -78.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 C-N-CA 128.406 2.682 . . . . 0.0 111.685 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -171.28 -86.7 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 124.166 1.936 . . . . 0.0 114.165 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -157.84 158.15 34.61 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 127.048 2.139 . . . . 0.0 111.649 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -27.54 69.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 119.175 0.898 . . . . 0.0 112.746 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -71.36 -50.97 26.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.077 1.308 . . . . 0.0 109.416 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 10.5 mt -74.46 -4.17 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.584 1.554 . . . . 0.0 109.857 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.03 -63.35 1.33 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.553 1.07 . . . . 0.0 108.715 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -51.62 -43.75 62.68 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 122.7 0.4 . . . . 0.0 110.215 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -54.06 51.26 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.568 0.747 . . . . 0.0 111.399 175.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 57.8 m -57.23 -35.74 70.05 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.512 1.125 . . . . 0.0 110.641 176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . 0.45 ' CG ' HD12 ' A' ' 464' ' ' LEU . 87.5 t80 -67.12 -57.9 5.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.095 0.862 . . . . 0.0 111.077 177.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.8 m -54.69 -45.03 73.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.069 -0.967 . . . . 0.0 109.183 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -62.0 -38.85 90.18 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.315 0.961 . . . . 0.0 110.575 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.6 t -62.98 -56.98 12.36 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.081 1.352 . . . . 0.0 110.672 174.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -49.09 -48.22 44.49 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.678 1.191 . . . . 0.0 108.19 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -57.9 -49.62 76.11 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -61.57 -35.27 77.32 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.777 1.231 . . . . 0.0 113.033 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.23 28.65 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 173.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -59.89 -43.14 94.95 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.285 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.4 -51.64 66.17 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 110.206 174.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 14.8 t -52.08 -49.31 63.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.295 1.038 . . . . 0.0 110.194 173.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.13 -39.67 86.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.652 -174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.63 -43.67 88.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 126.307 1.843 . . . . 0.0 109.696 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.06 -51.47 69.05 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 126.245 1.818 . . . . 0.0 109.298 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 4.5 mt -55.26 -51.6 66.11 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.74 1.216 . . . . 0.0 108.994 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.9 ttm-85 -58.82 -53.39 58.95 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.709 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -48.85 -51.81 27.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.827 1.251 . . . . 0.0 109.403 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.04 -38.53 82.63 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.467 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -50.83 70.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.106 1.762 . . . . 0.0 108.939 176.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 2.5 mt -57.9 -53.31 59.65 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.973 1.709 . . . . 0.0 108.96 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.5 -35.44 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 121.134 1.788 . . . . 0.0 109.985 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.17 -24.78 67.8 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.658 -1.276 . . . . 0.0 110.754 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -96.5 -1.54 47.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 116.179 -1.867 . . . . 0.0 109.773 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -43.11 14.2 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 122.974 2.625 . . . . 0.0 111.119 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -72.05 -3.76 24.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.601 2.36 . . . . 0.0 115.034 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -138.63 -89.31 0.22 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -176.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -41.46 29.94 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.21 1.804 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 72.36 80.04 0.42 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 109.08 -1.608 . . . . 0.0 109.08 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.45 158.27 0.29 Allowed 'General case' 0 C--O 1.238 0.487 0 O-C-N 124.937 1.022 . . . . 0.0 109.823 172.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.84 160.87 25.11 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.036 0.922 . . . . 0.0 110.489 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -37.84 74.22 Favored 'General case' 0 N--CA 1.458 -0.035 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.792 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.87 -53.34 57.08 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 125.717 1.607 . . . . 0.0 110.189 175.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -40.92 73.15 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.293 1.406 . . . . 0.0 112.457 174.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -63.1 -37.36 86.9 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.381 -1.45 . . . . 0.0 110.158 176.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.13 -38.84 72.28 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.042 -1.456 . . . . 0.0 108.958 177.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -50.91 -44.12 59.96 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.424 1.011 . . . . 0.0 109.361 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.58 -41.34 76.78 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 117.053 -1.451 . . . . 0.0 114.331 173.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -45.66 91.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 121.982 2.174 . . . . 0.0 107.085 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -54.11 49.88 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -41.77 66.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.038 1.735 . . . . 0.0 111.825 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.22 -39.7 89.78 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.55 -1.344 . . . . 0.0 109.885 -177.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -74.7 -21.42 59.4 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.152 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -81.15 -34.63 32.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.485 1.514 . . . . 0.0 111.359 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.681 0 C-N-CA 124.959 1.304 . . . . 0.0 111.464 174.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -42.53 78.27 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 116.1 -1.905 . . . . 0.0 109.246 173.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . 0.439 HD12 ' CH2' ' A' ' 522' ' ' TRP . 5.6 mm -58.24 -52.88 53.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.2 mt -50.88 -47.67 60.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 120.2 1.363 . . . . 0.0 110.264 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 56.5 mt -62.35 -58.07 9.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 124.969 1.307 . . . . 0.0 110.765 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -58.81 -37.52 90.51 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.885 2.183 . . . . 0.0 112.022 -177.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 81.1 mt -65.89 -41.95 90.9 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 117.523 -1.227 . . . . 0.0 108.838 173.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -30.3 68.19 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 120.202 1.365 . . . . 0.0 111.375 175.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 17.4 t -64.11 -54.8 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 124.582 1.153 . . . . 0.0 109.239 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -80.16 -10.12 59.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.916 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -138.17 74.11 43.17 Favored Pre-proline 0 N--CA 1.448 -0.528 0 C-N-CA 123.371 0.668 . . . . 0.0 110.783 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -65.55 -18.45 59.36 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.881 1.721 . . . . 0.0 112.066 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.23 -20.68 61.51 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 123.839 0.856 . . . . 0.0 110.329 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.404 HD12 ' CG ' ' A' ' 535' ' ' PHE . 27.3 mt -62.68 -12.81 25.87 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.926 1.694 . . . . 0.0 110.029 176.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.87 74.54 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.015 0.926 . . . . 0.0 111.13 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 51.6 m -78.59 -17.04 56.69 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.685 1.13 . . . . 0.0 111.262 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.52 -23.37 22.06 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.753 1.221 . . . . 0.0 110.821 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.54 150.78 76.79 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 118.54 0.609 . . . . 0.0 109.464 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -75.56 168.31 24.7 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.435 2.09 . . . . 0.0 112.124 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.49 3.87 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.703 3.602 . . . . 0.0 113.647 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.2 mp 68.54 63.47 0.34 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.604 1.962 . . . . 0.0 110.739 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -89.74 -38.98 13.45 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.779 0.8 . . . . 0.0 111.138 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -108.39 0.56 21.19 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.452 2.701 . . . . 0.0 110.808 -176.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.456 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.7 mm? -84.16 -91.15 0.09 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.247 -2.872 . . . . 0.0 103.247 -177.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 41.6 t0 65.02 150.36 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.764 1.626 . . . . 0.0 110.72 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -78.63 -17.97 55.21 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 120.147 -1.596 . . . . 0.0 109.072 -179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.33 -31.47 70.32 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.195 1.398 . . . . 0.0 111.216 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -94.93 -27.43 15.68 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.748 175.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -125.06 89.01 53.34 Favored Pre-proline 0 C--O 1.237 0.433 0 CA-C-N 119.321 0.964 . . . . 0.0 110.801 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.96 76.51 0.83 Allowed 'Trans proline' 0 CA--C 1.541 0.865 1 C-N-CA 125.962 4.442 . . . . 0.0 110.378 -175.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 144.7 -19.09 2.01 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.884 1.707 . . . . 0.0 113.905 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.94 -25.12 66.57 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 116.973 -1.489 . . . . 0.0 109.543 173.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -44.22 -42.32 6.82 Favored Glycine 0 C--O 1.217 -0.928 0 CA-C-N 120.449 1.477 . . . . 0.0 110.763 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 33.1 tp -58.17 -51.09 71.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.554 1.177 . . . . 0.0 112.643 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -58.2 -52.46 65.49 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 126.303 1.841 . . . . 0.0 110.79 173.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.35 -51.58 62.01 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.671 1.588 . . . . 0.0 108.58 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.39 -42.42 83.37 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.23 1.412 . . . . 0.0 109.974 -176.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -48.69 78.95 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 124.481 1.112 . . . . 0.0 110.615 177.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.62 -48.12 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 117.756 -1.116 . . . . 0.0 108.356 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -52.34 -41.65 63.21 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.117 1.326 . . . . 0.0 109.77 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.9 m -72.01 -42.16 66.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 126.513 1.925 . . . . 0.0 112.019 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.7 m -62.56 -39.77 94.73 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.199 1.363 . . . . 0.0 110.549 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -24.26 67.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.914 1.686 . . . . 0.0 111.975 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.58 -56.71 4.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.518 1.527 . . . . 0.0 107.997 174.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.9 100.0 0.23 Allowed Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 124.353 1.061 . . . . 0.0 111.267 -173.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.28 138.25 75.92 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 N-CA-C 107.274 -1.856 . . . . 0.0 107.274 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 55.93 36.61 67.36 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 124.528 1.061 . . . . 0.0 112.833 173.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.28 151.62 43.25 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.78 163.81 19.51 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.309 2.243 . . . . 0.0 107.665 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 91.6 m -58.57 -44.03 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.208 1.003 . . . . 0.0 111.18 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.46 -34.04 60.73 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -67.38 -29.0 68.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.616 1.208 . . . . 0.0 111.531 -177.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.87 -51.96 67.78 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.65 -30.22 67.15 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.454 0.702 . . . . 0.0 111.569 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -71.86 -43.73 64.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.11 0.868 . . . . 0.0 112.468 176.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -63.86 -18.28 64.0 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.078 1.751 . . . . 0.0 111.859 173.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -117.58 17.71 14.39 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.697 1.999 . . . . 0.0 110.688 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -62.03 -19.22 62.65 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 121.357 1.89 . . . . 0.0 114.158 -176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -136.06 42.26 1.34 Allowed Glycine 0 C--O 1.227 -0.311 0 C-N-CA 124.996 1.284 . . . . 0.0 110.852 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 48.7 m -108.09 145.99 33.26 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -21.35 65.39 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 121.217 -0.927 . . . . 0.0 112.011 174.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -88.95 -26.28 21.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 130.817 3.647 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -40.49 -43.89 1.93 Allowed 'General case' 0 C--O 1.206 -1.203 0 C-N-CA 124.24 1.016 . . . . 0.0 110.426 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.77 -52.63 47.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.876 1.67 . . . . 0.0 113.217 176.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 89.7 m -63.73 -45.21 90.91 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 124.842 1.257 . . . . 0.0 109.693 174.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 42.9 mt -60.52 -34.52 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.292 1.037 . . . . 0.0 111.21 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -40.77 64.46 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 127.04 2.136 . . . . 0.0 109.412 -178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -64.55 -37.94 89.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . 0.523 HD21 ' CE3' ' A' ' 522' ' ' TRP . 88.0 mt -77.32 -10.9 59.72 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 118.395 -0.812 . . . . 0.0 112.515 173.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 9.4 t -69.92 -66.04 0.64 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.192 1.397 . . . . 0.0 108.388 177.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.38 14.36 2.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.459 1.904 . . . . 0.0 111.742 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . 0.523 ' CE3' HD21 ' A' ' 519' ' ' LEU . 4.4 t90 -53.69 123.97 13.8 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -28.62 15.55 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.281 -173.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -49.75 -30.26 9.12 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 125.502 1.521 . . . . 0.0 111.031 -177.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.6 pt -110.27 -70.84 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 130.834 3.654 . . . . 0.0 112.457 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.38 52.09 3.67 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 126.877 2.071 . . . . 0.0 112.311 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -151.11 150.21 30.41 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.61 -174.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -106.88 -27.71 10.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.364 1.066 . . . . 0.0 111.983 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -87.66 -60.75 1.89 Allowed 'General case' 0 CA--C 1.51 -0.584 0 C-N-CA 124.567 1.147 . . . . 0.0 108.936 -177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 45.0 mt -55.55 -28.12 22.35 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.69 -60.32 3.16 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.814 1.246 . . . . 0.0 111.206 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -52.74 -42.97 65.41 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 119.058 0.844 . . . . 0.0 110.602 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -49.48 69.64 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.31 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 61.2 m -58.94 -31.37 68.63 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.156 1.782 . . . . 0.0 107.75 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . 0.404 ' CG ' HD12 ' A' ' 464' ' ' LEU . 39.4 t80 -66.55 -58.05 6.0 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 109.551 178.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 80.6 m -63.23 -39.6 95.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.706 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -60.02 -45.18 93.62 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.467 1.107 . . . . 0.0 108.361 175.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.7 t -70.4 -51.77 27.23 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.479 -1.388 . . . . 0.0 112.002 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.3 tt -46.8 -49.94 19.13 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 126.708 2.003 . . . . 0.0 111.083 170.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.267 0.9 OUTLIER -65.68 -33.56 76.18 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-O 116.04 -1.933 . . . . 0.0 110.342 179.071 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -72.04 -35.45 69.35 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.049 1.295 . . . . 0.0 110.36 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -57.72 9.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.456 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.5 m-85 -58.76 -42.38 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 126.487 1.915 . . . . 0.0 111.343 -177.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.68 -49.14 78.66 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 127.551 2.341 . . . . 0.0 109.096 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.6 t -56.59 -35.62 68.44 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.626 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 16.2 mt -74.0 -40.82 62.67 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.712 1.205 . . . . 0.0 111.087 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 30.8 mt -61.7 -44.86 96.13 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 117.517 -1.23 . . . . 0.0 109.0 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.046 0.938 . . . . 0.0 111.476 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -45.55 72.69 Favored 'General case' 0 CA--C 1.451 -2.85 0 C-N-CA 124.493 1.117 . . . . 0.0 111.346 173.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 -63.98 -51.07 66.01 Favored 'General case' 0 C--N 1.272 -2.777 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.69 -51.95 52.04 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.654 1.182 . . . . 0.0 109.149 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.89 -43.24 99.26 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.063 -176.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -40.21 95.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.196 1.798 . . . . 0.0 110.373 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 4.2 mt -60.72 -55.13 36.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.697 1.199 . . . . 0.0 107.835 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.9 mm -61.57 -39.54 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 120.255 1.389 . . . . 0.0 111.763 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -60.25 -18.29 47.87 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.503 1.521 . . . . 0.0 109.542 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.18 18.49 12.19 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 120.577 1.535 . . . . 0.0 111.39 173.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.85 -63.83 1.4 Allowed 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 121.164 1.802 . . . . 0.0 109.523 177.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -8.8 53.51 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.181 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.05 -43.01 3.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.358 1.435 . . . . 0.0 109.886 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -115.06 -74.18 0.62 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.495 1.518 . . . . 0.0 109.09 -173.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 148.62 109.18 0.52 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -79.78 132.74 36.22 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.3 t -66.57 165.32 14.86 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.88 -39.9 86.87 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.759 . . . . 0.0 110.624 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.73 -51.56 26.56 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 123.995 0.918 . . . . 0.0 109.343 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -59.0 -30.4 67.96 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 123.793 1.759 . . . . 0.0 111.526 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.97 -38.37 72.78 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 118.785 -2.447 . . . . 0.0 106.147 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 18.4 mt -67.76 -32.9 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.487 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.5 -43.55 62.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.131 1.332 . . . . 0.0 108.912 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -39.84 93.1 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 117.423 -1.275 . . . . 0.0 112.803 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -50.48 72.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.166 1.803 . . . . 0.0 108.172 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -35.91 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 124.146 0.904 . . . . 0.0 109.404 -175.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -52.61 37.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.789 1.636 . . . . 0.0 110.95 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -57.4 -46.22 83.7 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.464 1.906 . . . . 0.0 111.468 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.8 -24.72 65.33 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 111.66 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.21 -33.89 43.36 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 119.257 0.935 . . . . 0.0 109.346 173.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.875 0 C-N-CA 128.024 2.53 . . . . 0.0 109.869 -176.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 46.5 ttm . . . . . 0 N--CA 1.463 0.215 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -56.02 -19.23 11.85 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.26 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.4 mm -51.99 -52.14 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 125.167 1.387 . . . . 0.0 109.409 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.54 -42.71 67.76 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.494 0.588 . . . . 0.0 111.517 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 43.8 mt -69.39 -53.08 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.227 0.611 . . . . 0.0 109.553 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -64.18 -43.43 97.12 Favored Glycine 0 C--N 1.336 0.534 0 CA-C-N 118.749 0.704 . . . . 0.0 112.679 -173.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.22 -41.68 96.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.154 177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.77 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.83 0.741 . . . . 0.0 110.68 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.63 -50.96 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 121.599 -0.688 . . . . 0.0 109.541 173.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -72.59 -28.63 62.91 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.293 -174.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -133.55 84.47 45.61 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 126.895 2.078 . . . . 0.0 111.643 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -65.36 -21.48 61.03 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 121.945 1.763 . . . . 0.0 113.3 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.64 -17.02 62.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.069 0.849 . . . . 0.0 111.278 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.41 -15.58 58.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.207 -0.933 . . . . 0.0 110.673 173.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.77 -25.47 67.27 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 119.452 1.024 . . . . 0.0 111.047 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 7.9 m -83.41 -12.82 56.01 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.066 0.946 . . . . 0.0 110.789 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 20.8 mt -103.17 -7.55 21.15 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 112.478 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 14.9 p -92.32 137.89 24.5 Favored Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 119.995 1.27 . . . . 0.0 109.692 -177.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.05 164.72 24.0 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.17 2.58 . . . . 0.0 110.355 173.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.72 16.57 0.27 Allowed 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 123.474 2.783 . . . . 0.0 115.515 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.38 16.4 8.3 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 128.367 2.667 . . . . 0.0 113.249 175.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -57.79 -20.26 34.11 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.129 2.572 . . . . 0.0 115.396 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.3 10.08 19.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.34 1.456 . . . . 0.0 111.826 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 5.1 mp -124.13 -58.21 1.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.047 0.939 . . . . 0.0 111.731 -173.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 25.8 t0 64.59 157.25 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.533 1.533 . . . . 0.0 108.866 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -75.27 -21.96 58.14 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 119.711 -1.868 . . . . 0.0 107.576 173.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -61.8 -49.21 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.291 2.237 . . . . 0.0 113.202 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 48.0 mmtt -77.21 -20.31 55.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.715 -0.659 . . . . 0.0 112.497 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -120.78 88.29 43.69 Favored Pre-proline 0 N--CA 1.453 -0.282 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.53 87.95 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.99 2.46 . . . . 0.0 111.307 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.46 -19.02 2.82 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.276 1.893 . . . . 0.0 112.589 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 8.7 tt -62.77 -25.1 68.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.822 1.311 . . . . 0.0 111.499 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.66 -40.06 17.12 Favored Glycine 0 CA--C 1.527 0.822 0 CA-C-N 118.607 0.64 . . . . 0.0 112.054 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.89 -40.91 97.62 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.735 1.267 . . . . 0.0 112.696 174.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -61.86 -42.59 99.23 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.716 -1.24 . . . . 0.0 109.074 174.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -61.91 -47.56 84.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.294 1.038 . . . . 0.0 110.76 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.23 -56.44 14.67 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 127.238 2.215 . . . . 0.0 109.473 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.8 mp -56.25 -59.68 4.59 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.586 1.155 . . . . 0.0 109.784 -178.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 72.6 t -54.68 -42.86 63.38 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.164 0 C-N-CA 123.361 0.664 . . . . 0.0 109.628 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -59.64 -44.8 93.36 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 119.131 0.878 . . . . 0.0 110.798 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.5 m -63.76 -41.61 97.96 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 123.503 0.721 . . . . 0.0 109.898 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 88.5 m -62.97 -44.49 95.91 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 119.002 0.819 . . . . 0.0 110.074 -177.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -18.46 47.05 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.748 1.219 . . . . 0.0 112.817 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.8 t -99.46 -11.84 20.73 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.901 1.68 . . . . 0.0 113.023 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -106.29 90.69 4.95 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 125.234 1.414 . . . . 0.0 109.791 -176.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.23 122.7 10.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.845 1.697 . . . . 0.0 110.082 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 75.41 30.45 58.48 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 119.481 -0.622 . . . . 0.0 112.406 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 37.9 tp -56.07 153.3 9.18 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.81 0.805 . . . . 0.0 110.065 174.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -136.29 166.61 23.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.4 m -47.02 -49.99 20.15 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.098 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.32 -33.46 19.98 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -64.63 -27.19 68.77 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.373 0.669 . . . . 0.0 110.356 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.5 -48.65 74.38 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.358 0.663 . . . . 0.0 109.999 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.7 mp -62.67 -31.11 71.94 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.969 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -68.62 -48.84 63.07 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.693 0.679 . . . . 0.0 109.711 173.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -65.83 -20.66 66.32 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.688 -0.632 . . . . 0.0 112.349 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -107.11 8.81 30.39 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.977 0.911 . . . . 0.0 110.773 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.24 -14.88 12.43 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -173.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -118.54 12.29 12.27 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.722 1.153 . . . . 0.0 113.67 174.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.536 HG21 ' H ' ' A' ' 512' ' ' ASN . 90.8 m -94.06 146.97 23.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 119.849 1.825 . . . . 0.0 110.652 -174.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -9.87 9.8 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.396 1.078 . . . . 0.0 112.7 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.536 ' H ' HG21 ' A' ' 510' ' ' THR . 2.2 t-20 -94.82 -16.51 22.89 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.962 2.105 . . . . 0.0 112.201 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.45 -48.06 7.15 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.626 1.17 . . . . 0.0 113.232 -175.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.08 -43.92 87.29 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.311 0.505 . . . . 0.0 111.876 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.3 m -66.87 -37.91 85.32 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.722 -0.611 . . . . 0.0 110.726 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.37 -45.33 73.09 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.29 1.036 . . . . 0.0 110.965 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.24 -44.76 95.82 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -60.98 -35.39 76.68 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.857 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 39.8 mt -74.94 -27.14 60.07 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.412 1.46 . . . . 0.0 112.832 175.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 1.2 t -62.64 -47.23 84.63 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.86 12.99 11.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.635 1.574 . . . . 0.0 114.188 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -65.91 125.45 25.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.851 0.834 . . . . 0.0 111.732 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -81.44 -25.17 36.35 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 130.979 3.712 . . . . 0.0 114.308 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.64 -20.15 65.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.544 0.737 . . . . 0.0 112.331 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 4.9 pt -125.76 -64.62 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.268 1.027 . . . . 0.0 110.692 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 50.38 3.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 129.823 3.249 . . . . 0.0 118.179 174.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -114.92 164.84 13.57 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.724 1.147 . . . . 0.0 110.798 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.2 pttt -118.3 -13.43 9.84 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.942 1.697 . . . . 0.0 113.097 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.67 -53.56 4.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 120.44 1.473 . . . . 0.0 108.394 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.11 -24.39 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.149 1.779 . . . . 0.0 109.213 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.54 -45.34 66.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.455 1.102 . . . . 0.0 112.316 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -63.06 -51.6 66.03 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.364 0.984 . . . . 0.0 109.155 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -55.19 -44.76 75.59 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.378 0.671 . . . . 0.0 110.469 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.6 m -71.58 -29.69 65.0 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.652 0.781 . . . . 0.0 111.423 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -69.04 -51.42 39.21 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.69 1.132 . . . . 0.0 108.09 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 82.6 m -54.17 -45.45 72.09 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.305 1.042 . . . . 0.0 109.39 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -62.79 -47.72 82.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.043 0.838 . . . . 0.0 110.813 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -43.73 79.82 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.94 -52.52 62.71 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.991 0.917 . . . . 0.0 108.574 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -58.55 -45.11 89.63 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.963 0.905 . . . . 0.0 110.681 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -69.42 -35.04 75.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 119.414 1.006 . . . . 0.0 110.688 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -56.05 24.71 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 173.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -61.97 -48.34 80.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.931 0.893 . . . . 0.0 110.474 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -55.67 -42.13 74.68 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.035 2.134 . . . . 0.0 111.787 176.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.8 t -67.08 -39.49 86.83 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.49 0.716 . . . . 0.0 111.764 174.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 41.8 mt -68.23 -38.37 81.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.434 -0.791 . . . . 0.0 109.908 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -46.35 88.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 109.001 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -64.2 -43.25 95.61 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.405 0.682 . . . . 0.0 111.131 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.84 -49.22 77.14 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.948 -1.095 . . . . 0.0 111.203 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 38.4 ttt-85 -57.8 -40.41 79.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 124.456 1.102 . . . . 0.0 109.668 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -56.09 -49.21 74.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.248 174.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -66.88 -36.98 83.55 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.048 1.295 . . . . 0.0 111.41 -175.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -55.19 -52.36 63.58 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.209 1.404 . . . . 0.0 109.766 174.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 13.8 mt -60.86 -55.42 33.22 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.11 0.964 . . . . 0.0 110.332 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.5 mm -63.61 -31.81 54.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 O-C-N 121.726 -0.609 . . . . 0.0 109.972 -174.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.36 97.5 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.306 0.957 . . . . 0.0 109.927 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -69.06 -23.83 64.09 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 116.368 -1.777 . . . . 0.0 110.968 173.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.08 -41.0 74.67 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.795 2.543 . . . . 0.0 109.863 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -75.91 5.1 6.94 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -174.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.509 HG21 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.18 -79.98 0.14 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 119.176 0.898 . . . . 0.0 109.633 175.093 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.509 ' H ' HG21 ' A' ' 560' ' ' THR . 5.8 t-80 -47.39 -48.12 26.17 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 127.666 2.386 . . . . 0.0 113.662 -173.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 84.99 87.53 0.91 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 -173.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.3 172.52 11.03 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.78 158.7 24.18 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.268 0.627 . . . . 0.0 110.001 -175.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.46 -41.14 89.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.317 0.58 . . . . 0.0 109.44 174.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 566' ' ' GLU . 23.5 mp0 -57.08 -52.9 63.44 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 129.068 2.947 . . . . 0.0 107.784 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -62.61 -39.94 95.38 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.554 1.542 . . . . 0.0 111.394 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -23.75 63.44 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.177 -1.577 . . . . 0.0 110.271 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 57.0 mt -84.52 -38.99 19.37 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.145 1.378 . . . . 0.0 110.26 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -50.95 -44.49 60.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.844 1.202 . . . . 0.0 108.619 174.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 17.5 mt -53.55 -40.95 65.96 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.999 0.92 . . . . 0.0 112.874 174.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 121.102 1.774 . . . . 0.0 109.21 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.2 m -56.69 -52.96 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.476 1.11 . . . . 0.0 108.776 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.9 tp -52.81 -47.95 67.26 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.561 1.545 . . . . 0.0 111.042 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -60.23 -37.82 81.52 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.711 0.804 . . . . 0.0 112.31 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -80.03 -35.74 36.8 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.426 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.76 -31.89 72.1 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.566 0.746 . . . . 0.0 109.9 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--N 1.33 -0.256 0 C-N-CA 124.071 0.948 . . . . 0.0 110.638 178.255 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptm . . . . . 0 N--CA 1.453 -0.281 0 CA-C-O 120.482 0.182 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 23.5 mtt85 -74.9 -21.99 58.89 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.535 1.147 . . . . 0.0 110.34 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . 0.562 HD12 ' CH2' ' A' ' 522' ' ' TRP . 1.8 mm -75.14 -45.43 41.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.506 1.129 . . . . 0.0 109.346 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . 0.47 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 4.1 mm? -59.14 -47.23 86.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.578 1.174 . . . . 0.0 109.298 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 459' ' ' VAL . 24.3 mt -72.79 -54.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.134 . . . . 0.0 109.265 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -45.46 -49.27 11.36 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.552 1.157 . . . . 0.0 111.005 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 461' ' ' ASN . 38.3 mt -66.1 -42.7 88.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.452 0.737 . . . . 0.0 109.33 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -64.81 -26.91 68.55 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.517 1.136 . . . . 0.0 109.372 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.482 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 3.6 t -69.56 -52.56 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.446 1.091 . . . . 0.0 109.342 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . 0.4 ' O ' ' OG1' ' A' ' 500' ' ' THR . 4.4 mt-30 -75.49 -27.45 58.81 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.477 1.11 . . . . 0.0 110.23 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 457' ' ' LEU . 0.3 OUTLIER -129.6 90.04 45.01 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.513 1.133 . . . . 0.0 109.269 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 -13.81 21.2 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.451 1.764 . . . . 0.0 111.028 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -77.11 -9.41 58.72 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.497 1.123 . . . . 0.0 110.311 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 535' ' ' PHE . 18.7 mt -75.7 -15.16 60.33 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.443 1.089 . . . . 0.0 109.269 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -62.01 -31.53 71.92 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.517 1.136 . . . . 0.0 109.342 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 2.6 m -76.72 -13.22 60.06 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.53 1.144 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . 0.4 HD13 ' CD2' ' A' ' 464' ' ' LEU . 19.5 mt -97.07 -9.12 28.69 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.53 1.144 . . . . 0.0 109.232 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . 0.534 ' CG1' HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -97.62 146.43 31.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.483 1.114 . . . . 0.0 109.322 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . 0.517 ' HD2' ' CG2' ' A' ' 468' ' ' VAL . 18.3 Cg_endo -75.01 175.29 11.44 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 124.457 1.767 . . . . 0.0 111.034 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . 0.431 ' O ' ' HB2' ' A' ' 471' ' ' LEU . 18.5 Cg_endo -74.96 5.29 4.05 Favored 'Trans proline' 0 C--N 1.358 1.075 0 O-C-N 124.488 1.783 . . . . 0.0 111.018 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . 0.506 ' CD1' ' CD1' ' A' ' 474' ' ' LEU . 3.4 mm? 68.63 70.49 0.29 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.484 1.115 . . . . 0.0 109.301 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.68 -62.51 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 0.0 110.296 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.88 -1.39 34.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.125 . . . . 0.0 109.319 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.506 ' CD1' ' CD1' ' A' ' 471' ' ' LEU . 7.6 mt -90.88 -61.97 1.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 1.191 . . . . 0.0 109.261 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 15.8 t0 60.77 152.81 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.498 1.124 . . . . 0.0 109.215 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -90.42 15.84 9.92 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.468 1.105 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -111.65 -34.04 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.49 1.119 . . . . 0.0 109.328 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -81.05 -21.17 40.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 0.0 109.317 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . 0.456 ' CB ' ' HB2' ' A' ' 482' ' ' LEU . 46.4 mt -126.03 106.03 25.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.547 1.154 . . . . 0.0 109.313 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 73.98 4.17 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.502 1.79 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 152.18 -21.38 0.86 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.895 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . 0.456 ' HB2' ' CB ' ' A' ' 479' ' ' LEU . 2.1 tm? -54.3 -35.82 63.03 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 0.78 . . . . 0.0 109.336 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.29 -50.97 9.52 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.508 1.13 . . . . 0.0 111.047 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.47 -46.49 73.37 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.447 0.734 . . . . 0.0 109.348 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . 0.47 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 46.8 t80 -65.55 -40.35 92.75 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . 0.447 ' HB2' ' CD1' ' A' ' 482' ' ' LEU . 2.8 ttt85 -66.52 -49.12 67.56 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.511 1.132 . . . . 0.0 110.333 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.6 -47.22 80.09 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.495 1.122 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . 0.518 HD23 ' CE1' ' A' ' 507' ' ' TYR . 1.4 mt -63.42 -49.69 72.74 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.507 1.129 . . . . 0.0 109.279 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . 0.534 HG11 ' CG1' ' A' ' 468' ' ' VAL . 17.5 t -58.66 -49.75 81.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.529 1.143 . . . . 0.0 109.338 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -53.96 -39.38 65.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.474 1.109 . . . . 0.0 109.338 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 1.1 m -73.71 -44.19 57.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.117 . . . . 0.0 110.384 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . 0.402 ' SG ' ' CD2' ' A' ' 498' ' ' LEU . 66.5 m -56.1 -46.43 79.1 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.508 1.13 . . . . 0.0 108.227 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -22.19 43.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.508 1.13 . . . . 0.0 109.279 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.19 -53.25 5.91 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.572 1.17 . . . . 0.0 109.998 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.573 ' OE1' ' CD2' ' A' ' 506' ' ' HIS . 2.1 mp0 -61.51 110.99 3.62 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.433 1.083 . . . . 0.0 110.285 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 126.25 9.83 Favored 'Trans proline' 0 C--N 1.36 1.135 0 O-C-N 124.47 1.774 . . . . 0.0 110.919 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.06 41.32 99.84 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 124.479 1.112 . . . . 0.0 110.969 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . 0.402 ' CD2' ' SG ' ' A' ' 492' ' ' CYS . 43.2 tp -58.46 164.87 2.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.54 0.788 . . . . 0.0 109.387 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 503' ' ' LEU . 6.3 p -142.95 170.51 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.46 1.1 . . . . 0.0 110.403 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 460' ' ' GLN . 2.3 m -66.56 -35.05 79.27 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.44 1.087 . . . . 0.0 110.372 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -83.92 -55.06 2.88 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.479 1.112 . . . . 0.0 111.033 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -50.81 -29.65 12.2 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.459 0.741 . . . . 0.0 110.287 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . 0.482 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 21.9 tp -56.05 -58.81 6.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 0.0 109.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -56.98 -34.57 68.23 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.409 1.068 . . . . 0.0 109.357 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -64.32 -34.52 78.34 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . 0.573 ' CD2' ' OE1' ' A' ' 495' ' ' GLN . 68.8 t60 -71.69 -13.55 61.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 0.0 109.538 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . 0.518 ' CE1' HD23 ' A' ' 488' ' ' LEU . 37.6 m-85 -124.22 27.24 7.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 0.0 111.071 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.26 126.98 31.21 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.507 1.129 . . . . 0.0 110.352 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.12 29.11 57.27 Favored Glycine 0 CA--C 1.529 0.947 0 O-C-N 124.453 1.095 . . . . 0.0 111.002 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 19.0 m -109.02 136.78 47.97 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 0.763 . . . . 0.0 110.373 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 57.4 m-20 -58.75 -15.7 13.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.0 109.288 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 512' ' ' ASN . 0.6 OUTLIER -97.41 -22.42 16.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.483 1.115 . . . . 0.0 109.268 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -47.54 -36.08 9.93 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 0.0 109.263 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.49 41.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.452 1.095 . . . . 0.0 109.291 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 68.6 m -58.32 -42.42 86.7 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.461 1.1 . . . . 0.0 110.361 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . 0.471 HD22 ' CD1' ' A' ' 488' ' ' LEU . 13.6 mt -66.56 -33.64 76.13 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.408 1.067 . . . . 0.0 109.335 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -68.21 -47.72 67.12 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.477 1.111 . . . . 0.0 110.277 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -56.21 -38.64 71.29 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 1.146 . . . . 0.0 109.332 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 94.5 mt -72.4 -21.73 61.23 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.478 1.111 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.9 t -68.74 -59.33 3.18 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 0.0 110.071 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' MET . . . . . 0.403 ' O ' ' C ' ' A' ' 522' ' ' TRP . 0.3 OUTLIER -77.38 2.18 16.72 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.458 1.099 . . . . 0.0 111.009 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . 0.562 ' CH2' HD12 ' A' ' 453' ' ' ILE . 1.9 t90 -42.07 137.67 1.8 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.146 . . . . 0.0 107.918 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.56 1.89 8.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -66.77 -24.3 66.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.488 1.117 . . . . 0.0 109.402 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.549 HD12 ' CZ3' ' A' ' 522' ' ' TRP . 0.7 OUTLIER -113.46 -59.81 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.484 1.115 . . . . 0.0 109.239 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.36 61.76 2.09 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.448 1.092 . . . . 0.0 109.31 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -161.94 153.21 18.25 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.559 1.162 . . . . 0.0 109.325 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -115.93 -36.98 3.98 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.609 1.193 . . . . 0.0 109.29 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.53 -43.68 38.24 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.426 1.079 . . . . 0.0 109.291 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.0 mt -70.91 -12.39 16.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.461 1.101 . . . . 0.0 109.345 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.36 -58.19 9.24 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.44 1.088 . . . . 0.0 109.295 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -53.47 -48.07 69.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.411 1.069 . . . . 0.0 110.299 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -43.63 93.85 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.459 1.1 . . . . 0.0 110.304 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' THR . . . . . 0.44 HG21 ' CD1' ' A' ' 457' ' ' LEU . 3.7 m -66.47 -36.08 81.87 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.429 1.08 . . . . 0.0 110.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . 0.574 ' CZ ' ' HB3' ' A' ' 464' ' ' LEU . 18.9 t80 -61.51 -51.6 67.96 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.565 1.166 . . . . 0.0 111.033 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 53.8 m -64.61 -46.91 80.6 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.517 1.136 . . . . 0.0 110.345 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -58.37 -41.18 84.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.533 1.145 . . . . 0.0 109.286 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.7 t -69.8 -56.49 7.0 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.992 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . 0.547 HD23 ' CE1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -48.36 -43.54 33.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.483 1.114 . . . . 0.0 109.268 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.14 -38.26 90.42 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.496 1.122 . . . . 0.0 109.321 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -62.71 -46.6 87.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.558 1.161 . . . . 0.0 109.601 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' MET . . . . . 0.415 ' O ' ' HG ' ' A' ' 546' ' ' LEU . 1.1 ttp -63.48 -44.9 93.08 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.478 1.111 . . . . 0.0 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.547 ' CE1' HD23 ' A' ' 539' ' ' LEU . 5.8 m-85 -68.84 -35.13 76.57 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.526 1.141 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.01 -44.85 83.56 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.52 1.138 . . . . 0.0 109.258 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.2 t -52.98 -37.65 61.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 0.0 109.994 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 543' ' ' PHE . 1.2 mt -72.11 -50.58 26.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 0.0 109.234 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 79.1 mt -53.53 -36.15 61.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.542 1.151 . . . . 0.0 109.233 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -59.02 -55.33 36.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.8 -44.12 94.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.531 1.145 . . . . 0.0 109.304 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -48.85 62.59 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.527 1.142 . . . . 0.0 110.378 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . 0.405 ' HG3' ' CD2' ' A' ' 571' ' ' LEU . 27.1 tt0 -52.44 -45.7 66.11 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.528 1.142 . . . . 0.0 110.338 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.94 -47.76 79.2 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.548 1.155 . . . . 0.0 110.306 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -33.74 73.86 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.534 1.146 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.493 ' HB3' ' CD1' ' A' ' 571' ' ' LEU . 0.4 OUTLIER -69.87 -50.28 44.05 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 0.0 109.216 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . 0.465 HG12 ' CD2' ' A' ' 571' ' ' LEU . 28.0 mm -64.25 -30.6 50.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 124.523 1.139 . . . . 0.0 109.248 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' A' ' 560' ' ' THR . . . -57.14 -19.28 19.23 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.488 1.117 . . . . 0.0 109.346 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -104.44 3.43 32.17 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.546 1.154 . . . . 0.0 110.293 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . 0.524 ' CA ' HD21 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -104.86 -21.45 13.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.474 1.109 . . . . 0.0 110.298 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -108.83 7.62 26.26 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.609 1.193 . . . . 0.0 110.203 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 556' ' ' ALA . 16.9 p -114.01 -61.71 1.7 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.48 1.113 . . . . 0.0 110.362 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -118.93 -41.55 2.76 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.469 1.105 . . . . 0.0 109.567 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 558' ' ' GLU . . . 105.48 93.5 2.31 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.508 1.13 . . . . 0.0 111.028 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . 0.524 HD21 ' CA ' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -55.83 -174.5 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 0.767 . . . . 0.0 109.265 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.37 145.85 55.64 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.061 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . 0.47 ' O ' ' CD1' ' A' ' 569' ' ' LEU . 0.8 OUTLIER -52.94 -38.73 62.28 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.504 1.128 . . . . 0.0 109.265 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.51 -42.49 78.46 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.462 1.101 . . . . 0.0 110.312 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . 0.448 ' HB3' ' CD1' ' A' ' 563' ' ' LEU . 46.9 mm-40 -67.67 -41.16 84.15 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.557 1.161 . . . . 0.0 110.228 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 563' ' ' LEU . 0.7 OUTLIER -60.56 -36.49 78.61 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.518 1.136 . . . . 0.0 110.217 -179.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . 0.484 ' O ' ' CD1' ' A' ' 572' ' ' TRP . 7.6 mp -71.58 -37.62 70.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.493 1.12 . . . . 0.0 109.3 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -51.58 -37.65 50.76 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 110.367 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . 0.493 ' CD1' ' HB3' ' A' ' 554' ' ' LEU . 2.7 mt -60.21 -51.01 71.38 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.435 1.085 . . . . 0.0 109.29 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.603 ' CD2' ' N ' ' A' ' 573' ' ' THR . 0.0 OUTLIER -51.44 -57.55 8.68 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.503 1.127 . . . . 0.0 108.052 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.603 ' N ' ' CD2' ' A' ' 572' ' ' TRP . 1.4 m -55.12 -32.78 62.33 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.569 1.168 . . . . 0.0 110.421 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.5 tp -70.95 -41.41 71.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.359 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -59.6 -33.52 71.58 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 0.0 109.235 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -22.5 65.76 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.0 110.334 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.27 -27.63 24.28 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.586 1.179 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--N 1.327 -0.408 0 O-C-N 124.488 1.118 . . . . 0.0 109.341 179.911 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.436 0 CA-C-O 121.441 0.639 . . . . 0.0 110.08 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.76 -46.28 0.87 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.024 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.7 mm -57.18 -52.4 56.86 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 124.305 1.042 . . . . 0.0 108.247 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.0 mt -51.74 -42.61 62.45 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-O 117.835 -1.079 . . . . 0.0 111.413 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 92.9 mt -65.43 -62.68 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 CA-C-N 119.614 1.097 . . . . 0.0 109.945 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -57.12 -40.59 91.76 Favored Glycine 0 C--N 1.337 0.587 0 CA-C-N 120.073 1.306 . . . . 0.0 113.58 -173.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 26.2 mt -67.42 -45.53 75.84 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . 0.452 HD12 ' HG ' ' A' ' 492' ' ' CYS . 3.4 tm? -63.0 -33.83 76.25 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 119.153 0.888 . . . . 0.0 110.458 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . 0.42 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 25.5 t -62.89 -51.52 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.489 -0.757 . . . . 0.0 109.394 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.41 -14.92 60.92 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.743 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -144.81 77.42 13.42 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 126.961 2.104 . . . . 0.0 109.165 -174.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.6 -13.75 35.54 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.256 1.971 . . . . 0.0 111.688 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.64 -23.07 63.43 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.701 1.601 . . . . 0.0 110.224 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . 0.402 HD11 ' CD1' ' A' ' 535' ' ' PHE . 56.1 mt -58.77 -18.13 29.2 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.79 1.177 . . . . 0.0 111.022 173.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.3 -19.63 64.77 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.268 -0.895 . . . . 0.0 111.989 173.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 24.0 m -83.67 -18.71 37.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.879 0.872 . . . . 0.0 110.929 174.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 81.9 mt -95.32 -19.15 20.2 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.673 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -72.01 150.27 92.53 Favored Pre-proline 0 CA--C 1.552 1.055 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 177.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -74.69 172.92 15.28 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.958 3.106 . . . . 0.0 112.021 174.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.32 13.2 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 123.117 2.545 . . . . 0.0 114.339 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 2.6 mm? 61.79 60.59 1.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.262 2.225 . . . . 0.0 112.39 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.55 -68.88 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.353 1.061 . . . . 0.0 109.911 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -71.13 -0.55 9.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 17.7 mt -100.99 -81.72 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.23 1.012 . . . . 0.0 110.473 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.1 t0 62.95 153.28 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.126 1.77 . . . . 0.0 112.37 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -75.49 -22.89 56.81 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.696 -1.253 . . . . 0.0 109.484 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -52.15 -46.57 65.48 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 125.483 1.513 . . . . 0.0 110.674 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -83.07 -29.9 28.43 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 47.0 mt -128.1 98.5 26.78 Favored Pre-proline 0 C--O 1.232 0.167 0 CA-C-N 119.698 1.136 . . . . 0.0 109.738 -173.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.46 -22.67 38.62 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.262 1.975 . . . . 0.0 112.328 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -89.62 -13.95 60.5 Favored Glycine 0 CA--C 1.525 0.716 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.291 174.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.74 -25.56 63.89 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.972 1.386 . . . . 0.0 110.233 175.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.67 -47.01 13.18 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.382 0.992 . . . . 0.0 111.944 173.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 39.8 tp -60.36 -49.56 77.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 117.734 0.767 . . . . 0.0 110.921 174.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -57.66 -51.28 70.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.567 1.076 . . . . 0.0 111.457 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -54.17 -52.77 60.11 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.044 0.937 . . . . 0.0 109.655 176.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -61.87 -43.75 98.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.755 0.707 . . . . 0.0 110.356 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.99 -56.49 19.1 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.89 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.25 -47.55 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.601 0.637 . . . . 0.0 109.78 178.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.09 -40.94 77.92 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.477 1.035 . . . . 0.0 109.856 -176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 13.2 m -69.27 -39.77 78.18 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.226 1.411 . . . . 0.0 111.204 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . 0.452 ' HG ' HD12 ' A' ' 458' ' ' LEU . 99.5 m -62.17 -40.71 96.94 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.047 1.294 . . . . 0.0 110.472 176.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.03 -24.55 66.02 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 125.313 1.445 . . . . 0.0 111.113 175.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 7.1 t -79.8 -53.41 6.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.808 0.843 . . . . 0.0 110.599 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -68.9 104.64 0.77 Allowed Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 125.516 1.526 . . . . 0.0 110.018 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.23 125.68 12.17 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.261 1.974 . . . . 0.0 109.582 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 64.34 36.15 92.85 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 20.3 tp -57.1 156.21 7.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.653 0.739 . . . . 0.0 109.647 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 3.4 p -142.66 168.17 20.35 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.336 1.454 . . . . 0.0 108.193 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -52.3 -46.23 65.85 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.049 0.94 . . . . 0.0 110.738 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -76.69 -43.96 16.99 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -62.32 -27.82 69.31 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.4 1.08 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . 0.42 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 61.4 tp -59.03 -57.0 15.04 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 124.192 0.997 . . . . 0.0 108.506 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.2 mp -62.44 -31.54 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.535 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -63.37 -44.69 94.07 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.35 0.977 . . . . 0.0 110.657 176.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -63.88 -15.13 58.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.53 1.132 . . . . 0.0 111.887 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -116.23 21.61 13.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.982 1.313 . . . . 0.0 110.129 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -57.26 123.0 13.82 Favored 'General case' 0 C--O 1.227 -0.111 0 O-C-N 120.153 -1.592 . . . . 0.0 110.6 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 72.83 31.71 62.0 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.5 -0.611 . . . . 0.0 113.592 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 38.7 m -101.6 148.54 25.1 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.643 1.577 . . . . 0.0 110.073 178.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.24 -15.71 27.15 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.613 -0.679 . . . . 0.0 112.754 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -101.83 -21.46 14.58 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -44.86 -48.19 11.11 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 119.959 1.254 . . . . 0.0 110.101 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.82 81.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.766 1.167 . . . . 0.0 111.972 -177.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 54.1 m -63.21 -53.06 59.04 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 174.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 54.2 mt -55.14 -39.71 69.76 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 124.525 1.13 . . . . 0.0 110.552 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -68.87 -46.12 69.26 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 127.671 2.388 . . . . 0.0 110.234 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -56.8 -42.92 80.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.4 -14.37 59.42 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.378 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.1 t -73.03 -28.48 62.37 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.41 1.084 . . . . 0.0 110.432 174.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -2.15 21.31 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.095 1.358 . . . . 0.0 112.61 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 24.3 t90 -70.96 83.55 0.67 Allowed 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.8 0.84 . . . . 0.0 109.621 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -1.39 58.01 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.311 2.245 . . . . 0.0 111.312 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.18 51.23 0.67 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.481 2.313 . . . . 0.0 109.878 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 55.0 mt -135.85 -71.37 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.408 2.283 . . . . 0.0 107.542 -173.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -170.67 -89.87 0.01 OUTLIER 'General case' 0 C--N 1.351 0.633 0 C-N-CA 125.968 1.707 . . . . 0.0 110.755 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -164.8 164.54 21.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.897 3.279 . . . . 0.0 107.717 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 10.6 ttmm -62.27 -26.88 68.64 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.306 1.442 . . . . 0.0 110.331 173.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -78.41 -60.57 2.32 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 119.774 1.17 . . . . 0.0 110.386 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.87 -20.9 20.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.528 1.131 . . . . 0.0 110.638 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.44 -43.16 54.94 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.233 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -58.34 -48.32 80.93 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.502 1.501 . . . . 0.0 110.098 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -47.16 77.79 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.183 -0.948 . . . . 0.0 110.671 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 87.4 m -63.94 -26.44 68.59 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.159 1.384 . . . . 0.0 111.717 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . 0.402 ' CD1' HD11 ' A' ' 464' ' ' LEU . 88.9 t80 -72.21 -52.98 14.0 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 119.855 1.207 . . . . 0.0 108.68 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 23.1 m -61.86 -40.44 95.34 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 123.788 0.68 . . . . 0.0 110.285 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.02 -43.9 98.21 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.725 1.148 . . . . 0.0 110.847 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.0 t -64.6 -48.32 75.38 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 124.977 1.311 . . . . 0.0 111.895 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.19 -52.03 64.66 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-O 118.019 -0.991 . . . . 0.0 108.535 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -57.46 -41.02 79.76 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 123.933 0.893 . . . . 0.0 111.328 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -63.18 -38.99 93.33 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.144 0.429 . . . . 0.0 110.728 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.11 -51.28 59.42 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 121.595 -0.691 . . . . 0.0 109.704 176.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -57.77 -46.94 83.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.586 0.754 . . . . 0.0 110.745 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -54.99 -50.88 67.88 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.868 2.067 . . . . 0.0 110.025 173.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 12.3 t -53.66 -47.83 70.02 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 123.389 0.676 . . . . 0.0 109.878 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 60.7 mt -67.16 -42.34 84.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 119.292 0.951 . . . . 0.0 110.638 -175.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.49 -38.14 88.88 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.976 0.911 . . . . 0.0 110.158 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -52.22 37.65 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 126.03 1.732 . . . . 0.0 110.003 178.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 31.7 mt -52.49 -50.57 62.5 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 125.259 1.423 . . . . 0.0 107.932 173.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -40.21 94.66 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 120.691 -1.255 . . . . 0.0 111.449 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.01 -48.63 80.93 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.441 1.019 . . . . 0.0 108.329 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -42.08 95.44 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.331 -176.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -42.06 94.09 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.005 1.722 . . . . 0.0 110.282 -178.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.03 -30.85 64.05 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.367 177.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.1 mm -76.18 -31.98 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 120.127 1.33 . . . . 0.0 110.341 174.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.89 -29.99 70.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.469 1.507 . . . . 0.0 108.094 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -90.58 15.37 11.01 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.328 1.451 . . . . 0.0 109.417 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -97.82 -50.58 4.38 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 122.186 2.267 . . . . 0.0 109.674 174.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -0.24 12.87 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.033 1.333 . . . . 0.0 113.537 -174.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.563 ' CG2' ' H ' ' A' ' 561' ' ' HIS . 0.0 OUTLIER -131.89 -81.44 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 127.819 2.447 . . . . 0.0 108.984 179.385 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.563 ' H ' ' CG2' ' A' ' 560' ' ' THR . 0.1 OUTLIER -56.12 -77.18 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.549 2.34 . . . . 0.0 106.605 -174.14 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 136.42 124.58 2.37 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.346 1.451 . . . . 0.0 110.027 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.83 176.92 7.35 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.18 175.15 5.56 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.383 173.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.72 -42.31 97.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.47 -51.0 11.47 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.913 0.758 . . . . 0.0 108.977 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.16 -31.23 68.79 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 120.601 -1.312 . . . . 0.0 112.624 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -33.28 70.55 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.997 -1.065 . . . . 0.0 109.735 174.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.57 -37.83 80.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 117.74 -1.124 . . . . 0.0 109.251 176.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.45 -41.52 14.02 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.983 1.265 . . . . 0.0 109.931 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.42 -40.81 97.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.737 -1.227 . . . . 0.0 113.585 177.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -45.54 91.32 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.82 -30.55 70.76 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 123.773 0.67 . . . . 0.0 110.305 -177.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.7 -36.24 62.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.39 1.476 . . . . 0.0 111.312 174.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -66.15 -34.79 78.84 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.165 -1.584 . . . . 0.0 110.435 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -30.85 63.79 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.459 176.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -67.13 -41.92 85.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.662 1.585 . . . . 0.0 111.045 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 28.7 mt . . . . . 0 N--CA 1.475 0.783 0 CA-C-N 119.301 0.955 . . . . 0.0 111.884 177.926 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -63.66 -32.73 74.3 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 116.065 -1.922 . . . . 0.0 110.001 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.98 -53.14 46.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 CA-C-N 119.965 1.257 . . . . 0.0 108.749 174.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -44.5 70.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.029 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 93.1 mt -69.98 -53.77 22.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.41 -36.21 83.62 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.462 1.029 . . . . 0.0 113.313 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.3 mt -70.07 -39.08 75.84 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 117.575 0.687 . . . . 0.0 109.657 174.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . 0.51 HD11 ' HG ' ' A' ' 492' ' ' CYS . 3.2 tm? -62.22 -37.68 86.32 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.699 0.681 . . . . 0.0 109.967 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.1 t -59.18 -51.84 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.474 1.11 . . . . 0.0 109.118 173.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -75.29 -20.19 59.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.106 0.562 . . . . 0.0 111.248 -176.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -141.94 80.31 15.62 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 126.436 1.894 . . . . 0.0 110.094 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.62 -23.73 74.8 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.779 1.653 . . . . 0.0 113.612 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -64.36 -12.78 45.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.33 0.968 . . . . 0.0 112.921 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 34.2 mt -64.08 -16.23 61.29 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.673 -1.267 . . . . 0.0 109.564 173.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -61.46 -28.38 69.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.834 0.854 . . . . 0.0 110.873 173.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.9 m -83.86 -14.57 50.87 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.029 0.832 . . . . 0.0 112.15 173.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -92.75 -8.71 43.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 119.389 0.995 . . . . 0.0 111.755 176.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 6.0 p -81.03 149.01 65.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 CA-C-N 120.406 1.457 . . . . 0.0 109.333 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.48 170.13 20.09 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.501 2.801 . . . . 0.0 111.446 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -72.6 10.83 0.92 Allowed 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.686 2.924 . . . . 0.0 114.073 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.8 mp 74.73 26.45 1.39 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 128.236 2.615 . . . . 0.0 115.088 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -55.57 -16.5 4.04 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -175.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.07 16.46 8.48 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.72 1.208 . . . . 0.0 111.555 -178.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 4.5 mp -122.88 -56.45 1.76 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.424 1.09 . . . . 0.0 109.156 -173.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . 0.561 ' C ' ' H ' ' A' ' 477' ' ' ASN . 1.3 t70 50.1 24.03 1.3 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.418 1.887 . . . . 0.0 113.106 178.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 53.67 -11.66 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 1 C-N-CA 133.52 4.728 . . . . 0.0 114.169 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . 0.561 ' H ' ' C ' ' A' ' 475' ' ' ASP . 25.6 t30 -88.08 -35.08 17.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 131.512 3.925 . . . . 0.0 111.164 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -75.07 -9.29 58.4 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.552 1.524 . . . . 0.0 110.759 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 12.6 mt -135.79 96.19 13.44 Favored Pre-proline 0 N--CA 1.452 -0.332 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -71.3 82.13 1.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.8 2.333 . . . . 0.0 110.115 -177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 143.99 -17.03 2.16 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.792 1.663 . . . . 0.0 113.353 -174.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -67.89 -25.05 65.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.931 1.865 . . . . 0.0 109.928 174.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.26 -41.87 8.66 Favored Glycine 0 C--O 1.217 -0.927 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -46.31 87.46 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 118.906 1.353 . . . . 0.0 112.158 177.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -61.52 -49.93 74.73 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.56 0.744 . . . . 0.0 109.752 175.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.75 -49.97 70.89 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.183 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -56.74 -46.93 81.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.42 -51.47 68.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.001 0.92 . . . . 0.0 111.518 174.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.28 -44.31 87.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 119.486 1.039 . . . . 0.0 110.444 178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -60.9 -45.53 94.24 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.455 1.502 . . . . 0.0 108.924 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 19.7 m -62.01 -42.77 99.52 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.496 1.518 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . 0.51 ' HG ' HD11 ' A' ' 458' ' ' LEU . 81.1 m -64.96 -41.79 95.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 120.756 1.616 . . . . 0.0 110.816 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.3 -22.07 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.504 1.122 . . . . 0.0 111.978 174.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 19.8 t -88.65 -39.08 14.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.671 1.188 . . . . 0.0 111.286 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -76.19 105.51 2.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.249 1.02 . . . . 0.0 109.775 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.83 117.57 5.18 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 121.865 1.71 . . . . 0.0 110.513 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 71.05 35.12 64.6 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 177.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.83 158.28 4.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.612 0.765 . . . . 0.0 111.17 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.62 168.92 18.37 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -50.48 -51.21 49.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.204 1.402 . . . . 0.0 110.686 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.79 -39.48 33.77 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -176.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -64.67 -25.45 67.95 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.307 0.643 . . . . 0.0 111.48 -177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.93 -52.52 65.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.562 0.745 . . . . 0.0 109.408 174.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 8.9 mp -62.95 -37.49 87.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.148 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.32 -39.1 85.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.11 0.564 . . . . 0.0 111.232 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -64.69 -20.52 66.36 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -114.9 16.47 17.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.444 1.497 . . . . 0.0 109.817 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -52.37 125.62 16.65 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.123 -1.61 . . . . 0.0 110.072 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 80.36 11.34 84.33 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.883 -0.954 . . . . 0.0 113.916 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' THR . . . . . 0.417 HG21 ' H ' ' A' ' 512' ' ' ASN . 35.2 m -93.27 147.4 22.95 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 120.133 1.966 . . . . 0.0 108.448 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.09 -15.63 46.54 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 177.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . 0.417 ' H ' HG21 ' A' ' 510' ' ' THR . 0.1 OUTLIER -92.3 -17.85 24.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.694 1.598 . . . . 0.0 112.403 173.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.33 -38.27 68.51 Favored 'General case' 0 C--O 1.198 -1.654 0 C-N-CA 124.581 1.152 . . . . 0.0 110.466 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.14 -46.24 65.32 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 122.755 0.422 . . . . 0.0 110.618 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 97.7 m -61.58 -48.67 79.91 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.015 -1.053 . . . . 0.0 109.949 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.81 -40.66 96.02 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.678 0.791 . . . . 0.0 111.864 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -62.8 -45.83 90.82 Favored 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.805 1.642 . . . . 0.0 108.532 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -63.32 -30.06 71.26 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.234 -0.889 . . . . 0.0 112.066 174.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 22.3 mt -85.37 -14.45 46.32 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.857 1.208 . . . . 0.0 113.237 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.8 t -75.01 -54.83 6.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.654 1.182 . . . . 0.0 108.175 177.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -74.53 13.01 0.67 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.068 2.147 . . . . 0.0 113.589 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -82.81 97.28 8.54 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.824 1.25 . . . . 0.0 113.265 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.0 14.11 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 129.134 2.973 . . . . 0.0 112.526 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -61.13 -25.07 66.73 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.425 1.89 . . . . 0.0 111.375 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.73 -48.55 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 127.683 2.393 . . . . 0.0 111.358 176.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 52.31 20.51 1.41 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.119 2.568 . . . . 0.0 115.629 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -137.74 172.14 13.39 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.728 -1.232 . . . . 0.0 110.492 -173.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -124.29 -16.49 6.4 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.076 1.35 . . . . 0.0 113.844 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.36 -53.36 4.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.849 2.46 . . . . 0.0 107.756 175.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.34 -25.91 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.383 175.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.92 -59.52 4.05 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.962 1.305 . . . . 0.0 111.185 174.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.6 -44.08 80.77 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.05 0.841 . . . . 0.0 111.04 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -51.67 64.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.643 0.777 . . . . 0.0 109.793 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 53.1 m -66.36 -30.49 70.9 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.151 1.38 . . . . 0.0 110.825 -176.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.54 -56.18 15.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 176.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 98.2 m -59.46 -38.03 79.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.666 0.786 . . . . 0.0 111.258 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.11 -47.55 79.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.495 1.141 . . . . 0.0 111.237 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 24.5 t -65.62 -43.35 89.8 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 120.788 -1.195 . . . . 0.0 111.581 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.8 -50.28 63.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 118.989 0.813 . . . . 0.0 109.906 174.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -57.27 -43.97 83.55 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 123.346 0.658 . . . . 0.0 109.794 175.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.73 -40.61 88.44 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 119.312 0.96 . . . . 0.0 111.873 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.72 -51.89 67.69 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.73 -41.97 95.56 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.867 0.867 . . . . 0.0 111.316 -177.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.6 -49.73 74.04 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.344 2.258 . . . . 0.0 109.136 174.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 17.4 t -56.78 -43.79 81.21 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 123.471 0.708 . . . . 0.0 110.591 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.45 -37.25 80.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.768 1.167 . . . . 0.0 110.358 -177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 72.0 mt -70.27 -41.6 73.23 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.673 -0.68 . . . . 0.0 109.901 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.36 -50.82 68.43 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.347 1.459 . . . . 0.0 109.546 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.47 -47.14 73.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.072 0.949 . . . . 0.0 109.308 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -57.95 -44.84 87.22 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.303 0.956 . . . . 0.0 110.909 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -52.82 36.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.251 1.02 . . . . 0.0 109.87 173.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.08 -43.18 96.19 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.848 0.749 . . . . 0.0 110.53 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . 0.457 ' CG ' HH22 ' A' ' 557' ' ' ARG . 1.5 tp10 -59.98 -39.13 84.65 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.802 1.241 . . . . 0.0 110.096 -175.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.63 -53.28 56.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.561 1.544 . . . . 0.0 109.379 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 42.8 mm -60.58 -36.33 69.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-N 119.393 0.997 . . . . 0.0 110.93 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.0 -21.5 66.52 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.217 -1.552 . . . . 0.0 111.724 176.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . 0.457 HH22 ' CG ' ' A' ' 553' ' ' GLU . 4.2 ttm105 -84.57 -10.67 57.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 115.632 -2.128 . . . . 0.0 111.377 173.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -64.36 0.95 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 121.093 1.769 . . . . 0.0 110.257 174.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -71.56 3.23 4.11 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.816 1.247 . . . . 0.0 114.144 -173.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 46.8 p -118.72 -51.11 2.38 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.612 1.165 . . . . 0.0 111.343 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -50.56 2.83 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.734 1.214 . . . . 0.0 111.163 -174.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 123.5 131.91 3.86 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 126.29 1.9 . . . . 0.0 109.712 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.8 mt -86.56 137.85 32.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 6.3 t -68.86 167.3 15.9 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.224 1.012 . . . . 0.0 110.408 173.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -42.75 84.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.508 175.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -48.77 58.36 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 124.591 1.156 . . . . 0.0 109.823 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -60.7 -38.82 86.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.409 0.684 . . . . 0.0 110.858 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -62.48 -35.6 79.84 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.38 -0.825 . . . . 0.0 109.629 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 6.2 mp -71.96 -43.15 65.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 117.14 -1.41 . . . . 0.0 110.881 173.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -51.99 -37.49 53.36 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.469 1.031 . . . . 0.0 109.522 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.8 mt -62.9 -42.12 99.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 116.608 -1.663 . . . . 0.0 113.483 174.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -58.39 -44.96 89.17 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 121.37 1.896 . . . . 0.0 108.482 175.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -48.61 76.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -175.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.2 -42.11 98.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.74 1.216 . . . . 0.0 111.373 177.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -57.35 -45.36 84.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.365 0.666 . . . . 0.0 109.333 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -73.25 -27.45 61.59 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.135 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.09 -36.86 80.48 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.667 1.587 . . . . 0.0 109.564 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.4 mt . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 123.799 0.84 . . . . 0.0 111.805 177.618 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.9 ptt? . . . . . 0 C--O 1.224 -0.243 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.96 -21.98 65.95 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 116.907 -1.52 . . . . 0.0 111.046 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.74 52.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 C-N-CA 126.181 1.792 . . . . 0.0 109.453 173.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 32.6 mt -53.5 -45.08 69.53 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 118.657 0.662 . . . . 0.0 109.906 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 95.7 mt -72.18 -51.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.341 176.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -65.04 -32.43 84.13 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-N 121.431 1.923 . . . . 0.0 113.373 -173.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 71.4 mt -70.39 -40.22 74.07 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.17 174.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -34.44 77.82 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.932 1.293 . . . . 0.0 109.99 174.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 16.4 t -60.65 -58.65 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -71.77 -22.32 61.61 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.19 -177.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.44 77.53 53.13 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 127.051 2.141 . . . . 0.0 108.455 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.08 -13.67 36.81 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 121.311 1.341 . . . . 0.0 112.485 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -70.49 -19.79 62.9 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.725 0.81 . . . . 0.0 111.323 173.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 36.0 mt -62.96 -15.66 56.69 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.399 1.454 . . . . 0.0 110.571 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.97 72.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 119.36 0.982 . . . . 0.0 110.832 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.1 m -74.84 -19.48 60.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.997 0.817 . . . . 0.0 110.792 174.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 25.1 mt -91.0 -22.56 20.74 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 120.865 -1.147 . . . . 0.0 110.798 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -70.06 156.34 91.96 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 118.947 0.794 . . . . 0.0 110.244 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -74.74 174.01 13.42 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 124.475 3.45 . . . . 0.0 112.448 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -76.71 12.04 1.77 Allowed 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 121.698 1.599 . . . . 0.0 113.519 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 10.2 mp 64.54 46.86 3.11 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.766 2.426 . . . . 0.0 112.428 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.03 -42.12 60.78 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -105.68 17.76 23.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.765 1.226 . . . . 0.0 111.053 -175.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -97.64 -77.56 0.5 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -173.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 31.3 t0 64.41 141.42 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.258 2.223 . . . . 0.0 112.781 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -68.44 -20.06 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 120.997 -1.065 . . . . 0.0 109.547 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -62.31 -45.61 92.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.93 1.292 . . . . 0.0 110.285 173.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -80.62 -35.74 33.6 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 121.661 -0.649 . . . . 0.0 110.124 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -121.37 103.58 41.45 Favored Pre-proline 0 CA--C 1.534 0.344 0 C-N-CA 124.032 0.933 . . . . 0.0 108.876 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.11 -20.45 33.19 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.544 1.496 . . . . 0.0 112.356 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.9 -8.9 61.47 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.703 -1.054 . . . . 0.0 112.742 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -32.33 71.05 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 116.256 -1.831 . . . . 0.0 109.721 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.46 -48.73 16.36 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.572 1.533 . . . . 0.0 111.238 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.68 -44.89 95.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.836 -0.803 . . . . 0.0 111.692 175.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -64.37 -48.79 74.15 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 119.115 0.871 . . . . 0.0 111.718 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.23 -53.63 51.0 Favored 'General case' 0 CA--C 1.504 -0.811 0 C-N-CA 125.272 1.429 . . . . 0.0 108.186 175.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.07 -41.58 92.72 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.629 1.104 . . . . 0.0 110.872 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.42 -56.86 15.88 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.136 0.974 . . . . 0.0 110.158 173.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.5 t -58.7 -46.34 90.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -55.97 -46.45 78.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 125.779 1.632 . . . . 0.0 108.755 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 24.0 m -62.15 -44.13 97.3 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 125.81 1.644 . . . . 0.0 111.072 174.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.19 -37.12 86.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.069 0.849 . . . . 0.0 110.594 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -28.42 70.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.003 1.321 . . . . 0.0 109.679 174.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.67 -57.09 4.0 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.26 -0.9 . . . . 0.0 110.329 174.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -61.03 108.59 1.55 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.604 1.162 . . . . 0.0 110.241 -175.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -73.81 141.02 29.83 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 122.238 1.959 . . . . 0.0 109.398 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 50.24 33.58 23.59 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.097 1.332 . . . . 0.0 111.873 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 36.8 tp -54.03 156.3 3.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.976 1.37 . . . . 0.0 109.651 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -135.05 163.77 29.13 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 8.3 m -50.84 -46.97 60.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 125.593 1.557 . . . . 0.0 110.468 174.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.93 -41.6 27.38 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 28.1 tp60 -62.33 -24.67 67.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.609 -0.936 . . . . 0.0 110.459 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 40.9 tp -68.37 -45.36 72.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 119.606 1.094 . . . . 0.0 108.902 174.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.66 -38.62 85.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.608 -0.711 . . . . 0.0 111.012 175.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.26 -39.35 82.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.126 0.571 . . . . 0.0 111.355 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -66.98 -20.46 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 120.539 -1.35 . . . . 0.0 112.144 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -111.35 15.05 21.55 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.476 1.11 . . . . 0.0 109.931 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -54.63 128.59 33.09 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 119.985 -1.697 . . . . 0.0 110.173 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 76.7 15.42 81.6 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.272 -0.738 . . . . 0.0 114.108 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 53.7 m -93.98 145.95 24.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.885 1.343 . . . . 0.0 110.844 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -59.41 -22.87 62.06 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.025 -1.047 . . . . 0.0 111.427 174.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.63 -13.95 28.83 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 123.786 0.835 . . . . 0.0 112.533 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.29 -43.23 74.58 Favored 'General case' 0 C--O 1.209 -1.028 0 O-C-N 123.558 0.536 . . . . 0.0 109.735 173.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.46 -43.51 75.56 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 112.624 177.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 87.3 m -63.24 -50.06 71.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.376 -0.827 . . . . 0.0 109.141 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 48.7 mt -58.74 -42.15 88.11 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.565 0.746 . . . . 0.0 112.399 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.74 -42.74 81.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.304 1.842 . . . . 0.0 108.608 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -59.15 -30.68 68.33 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.515 -0.755 . . . . 0.0 111.01 173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 56.3 mt -89.29 -3.86 58.35 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.19 0.905 . . . . 0.0 111.913 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.0 t -79.1 -50.48 10.97 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.117 1.367 . . . . 0.0 109.396 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.57 9.77 8.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -59.97 112.67 1.96 Allowed 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 125.556 1.542 . . . . 0.0 115.01 -173.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.96 -29.22 49.69 Favored 'General case' 0 C--N 1.326 -0.432 1 C-N-CA 131.76 4.024 . . . . 0.0 114.389 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -53.81 -27.31 28.57 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.224 1.81 . . . . 0.0 112.786 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -123.53 -66.88 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 C-N-CA 124.673 1.189 . . . . 0.0 110.472 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.23 42.32 13.29 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.243 1.417 . . . . 0.0 114.005 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.58 172.13 13.24 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.856 -1.152 . . . . 0.0 111.4 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.44 -27.96 3.39 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.938 2.095 . . . . 0.0 111.906 175.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -80.9 -54.48 5.55 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.413 1.085 . . . . 0.0 108.513 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.84 -15.0 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 124.721 1.208 . . . . 0.0 109.598 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.41 -60.95 2.93 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 119.969 1.259 . . . . 0.0 110.746 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -55.96 -40.72 73.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.912 0.778 . . . . 0.0 111.31 -177.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -53.1 54.52 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.194 -0.316 . . . . 0.0 111.541 177.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 86.4 m -63.78 -27.39 69.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.184 0.993 . . . . 0.0 110.758 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -67.72 -53.25 28.97 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 120.173 1.351 . . . . 0.0 107.684 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 72.9 m -66.22 -39.09 89.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.291 -0.862 . . . . 0.0 111.213 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.38 -44.33 97.35 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.612 1.097 . . . . 0.0 109.614 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 t -61.22 -55.11 35.82 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 120.954 -1.091 . . . . 0.0 110.604 176.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.12 -44.34 79.04 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 125.009 1.323 . . . . 0.0 108.831 -178.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.01 -44.0 98.06 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.353 0.979 . . . . 0.0 110.428 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -67.55 -40.75 84.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.891 0.769 . . . . 0.0 111.539 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.2 mmt -59.44 -53.1 62.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 121.14 -0.975 . . . . 0.0 109.504 173.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.69 -45.09 93.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.545 0.738 . . . . 0.0 111.428 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -57.67 -46.76 83.83 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.051 1.34 . . . . 0.0 109.807 177.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.7 t -56.15 -39.12 71.8 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.484 0.714 . . . . 0.0 110.893 174.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 38.2 mt -73.89 -35.04 64.65 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 120.675 -1.266 . . . . 0.0 110.819 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.8 -43.6 79.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.661 1.185 . . . . 0.0 108.737 175.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.49 -53.58 56.53 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.554 1.142 . . . . 0.0 110.571 174.103 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 56.5 mt -57.41 -43.21 83.56 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.815 -0.553 . . . . 0.0 110.325 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -59.29 -44.06 92.52 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 117.231 -1.366 . . . . 0.0 109.464 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.38 -50.74 66.8 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 119.329 0.968 . . . . 0.0 110.209 176.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -44.92 89.14 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.675 -0.678 . . . . 0.0 110.039 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -41.42 96.19 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.159 0.984 . . . . 0.0 109.769 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 10.7 mt -60.85 -52.46 64.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.602 1.561 . . . . 0.0 108.909 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.3 mm -61.62 -36.27 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-N 119.967 1.258 . . . . 0.0 111.162 174.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.47 -24.88 66.88 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.277 -1.514 . . . . 0.0 110.745 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -84.65 -7.03 59.38 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 115.808 -2.044 . . . . 0.0 111.659 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.13 -60.33 2.56 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 122.54 2.427 . . . . 0.0 106.525 173.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -76.08 -4.4 41.23 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.301 -1.499 . . . . 0.0 113.99 -173.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -114.88 -63.67 1.42 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 121.171 1.805 . . . . 0.0 109.884 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -74.89 -44.51 48.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.538 1.135 . . . . 0.0 111.499 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 111.99 3.98 26.17 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 116.339 -2.367 . . . . 0.0 113.65 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 4.1 mt 41.17 -159.05 0.01 OUTLIER 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 127.866 2.467 . . . . 0.0 110.915 -173.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 29.6 t -139.33 160.23 40.32 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -40.17 74.07 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.3 -52.09 13.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.884 0.874 . . . . 0.0 109.603 -178.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.96 -36.54 75.0 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.297 0.953 . . . . 0.0 111.325 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 17.8 ttt85 -61.83 -32.58 72.91 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.128 -1.608 . . . . 0.0 111.138 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 85.9 mt -80.71 -33.44 35.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.954 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -53.36 -46.1 69.44 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 5.5 mt -56.45 -40.5 74.92 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 116.868 -1.539 . . . . 0.0 113.605 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.33 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 122.405 2.366 . . . . 0.0 109.071 175.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 2.8 m -62.31 -47.61 83.5 Favored 'General case' 0 CA--C 1.528 0.112 0 O-C-N 125.114 1.509 . . . . 0.0 107.215 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.28 87.24 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.712 -1.242 . . . . 0.0 111.001 177.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -65.08 -37.14 86.55 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.041 -1.037 . . . . 0.0 111.184 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -75.53 -25.38 57.14 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.679 -1.153 . . . . 0.0 110.364 175.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -45.58 77.6 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.416 1.007 . . . . 0.0 108.339 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 N--CA 1.471 0.584 0 C-N-CA 124.782 1.233 . . . . 0.0 112.844 179.294 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 121.193 0.521 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 71.2 mtt-85 -56.76 -27.64 59.81 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 115.513 -2.184 . . . . 0.0 109.978 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.8 mm -64.77 -53.22 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 119.858 1.208 . . . . 0.0 108.861 174.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . 0.46 HD21 ' CE1' ' A' ' 535' ' ' PHE . 11.6 mt -59.44 -46.8 87.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.394 0.997 . . . . 0.0 110.147 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 15.7 mt -68.29 -57.87 7.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.999 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.973 178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . 0.462 ' HA3' ' CE3' ' A' ' 522' ' ' TRP . . . -52.62 -42.52 58.4 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 126.285 1.898 . . . . 0.0 111.577 -178.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.26 -44.25 76.0 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-O 117.693 -1.146 . . . . 0.0 109.686 173.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.78 -30.78 69.12 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.626 1.103 . . . . 0.0 110.893 175.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.11 -49.94 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -74.96 -18.89 60.31 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.484 0.659 . . . . 0.0 111.922 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -137.56 83.82 24.43 Favored Pre-proline 0 N--CA 1.44 -0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 107.862 -173.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -68.51 -19.86 42.15 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.596 1.531 . . . . 0.0 111.852 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.03 -28.54 70.16 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.214 173.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 15.8 mt -59.87 -16.98 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.609 -1.307 . . . . 0.0 111.766 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -60.08 -27.47 67.01 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.85 -0.531 . . . . 0.0 111.221 173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 -16.51 49.56 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 120.139 -1.601 . . . . 0.0 112.847 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 8.3 mt -85.16 -18.57 33.73 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.777 1.231 . . . . 0.0 108.827 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . 0.405 HG11 ' CG1' ' A' ' 489' ' ' VAL . 0.5 OUTLIER -66.87 148.63 98.78 Favored Pre-proline 0 N--CA 1.439 -0.99 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.782 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -73.95 179.43 5.72 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 122.099 1.866 . . . . 0.0 111.04 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -79.72 14.45 1.85 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.826 3.018 . . . . 0.0 112.208 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 69.09 70.35 0.27 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 126.375 1.87 . . . . 0.0 107.693 174.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -105.39 -57.79 1.99 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.062 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -80.79 11.93 3.56 Favored 'General case' 0 CA--C 1.498 -1.046 0 C-N-CA 123.565 0.746 . . . . 0.0 112.491 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 36.8 mt -119.59 -49.99 2.33 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.915 0.886 . . . . 0.0 111.389 -173.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.4 t70 46.39 25.45 0.38 Allowed 'General case' 0 C--N 1.363 1.184 0 C-N-CA 128.6 2.76 . . . . 0.0 111.165 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 40.9 26.39 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 129.378 3.071 . . . . 0.0 112.874 -175.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -135.1 15.6 3.51 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 131.377 3.871 . . . . 0.0 111.607 -177.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 5.4 mmpt? -97.49 -42.76 7.56 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.591 174.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.98 145.47 43.78 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -72.5 5.67 2.7 Favored 'Trans proline' 0 N--CA 1.477 0.544 0 C-N-CA 123.314 2.676 . . . . 0.0 114.258 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -125.32 -11.28 4.25 Favored Glycine 0 N--CA 1.44 -1.074 0 CA-C-O 116.752 -2.138 . . . . 0.0 109.593 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.35 -45.08 69.01 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 119.905 1.852 . . . . 0.0 107.565 -178.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -50.75 -49.5 40.7 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 176.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 30.2 tp -61.38 -53.19 59.81 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 118.281 1.041 . . . . 0.0 111.085 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.41 -48.08 65.92 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 123.534 0.734 . . . . 0.0 110.865 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -59.67 -50.84 72.29 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.74 -44.56 96.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.818 0.847 . . . . 0.0 111.324 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 4.7 mt -59.17 -45.56 90.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.232 1.013 . . . . 0.0 109.755 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . 0.405 ' CG1' HG11 ' A' ' 468' ' ' VAL . 72.8 t -65.69 -45.05 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.517 176.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -54.19 -42.85 70.18 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.379 1.071 . . . . 0.0 109.776 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.3 m -71.65 -43.26 66.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.173 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 57.4 m -55.85 -48.41 75.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.776 1.171 . . . . 0.0 109.583 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.1 -21.27 58.99 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 125.85 1.66 . . . . 0.0 110.745 177.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.48 5.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.075 0.95 . . . . 0.0 109.791 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -63.12 104.64 0.52 Allowed Pre-proline 0 N--CA 1.468 0.452 0 C-N-CA 125.837 1.655 . . . . 0.0 110.496 -176.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -70.5 133.21 23.71 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 121.328 1.352 . . . . 0.0 110.485 -178.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.79 37.91 52.8 Favored Glycine 0 N--CA 1.469 0.853 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.82 156.09 9.37 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.393 0.616 . . . . 0.0 109.935 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.48 168.36 19.08 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -174.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.0 m -58.18 -38.03 75.89 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.55 0.74 . . . . 0.0 110.041 173.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.18 -41.38 8.04 Favored Glycine 0 C--N 1.339 0.724 0 O-C-N 120.798 -1.189 . . . . 0.0 110.431 -177.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.57 -27.87 68.02 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 117.679 -1.153 . . . . 0.0 109.691 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.39 -53.81 42.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 119.601 1.091 . . . . 0.0 109.646 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.28 -34.58 75.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.457 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -71.94 -35.46 69.63 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.327 0.651 . . . . 0.0 111.946 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -72.55 -5.21 35.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.089 2.156 . . . . 0.0 111.676 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . 0.428 ' CD2' HD12 ' A' ' 516' ' ' LEU . 44.0 m-85 -122.83 18.29 10.21 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.864 1.666 . . . . 0.0 109.774 174.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.67 134.51 56.88 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 119.525 -1.985 . . . . 0.0 109.292 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 70.53 21.44 77.63 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.023 176.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 95.3 m -94.43 144.78 25.27 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.341 1.571 . . . . 0.0 108.697 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -63.02 -17.27 62.03 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.469 -0.769 . . . . 0.0 109.11 173.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -96.95 -20.59 17.99 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 119.318 -2.114 . . . . 0.0 111.246 176.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -45.18 -39.78 6.54 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 124.889 1.368 . . . . 0.0 109.278 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.48 20.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 111.201 177.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 98.4 m -57.86 -41.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.354 0 O-C-N 120.675 -1.265 . . . . 0.0 110.713 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . 0.428 HD12 ' CD2' ' A' ' 507' ' ' TYR . 28.8 mt -64.96 -31.62 72.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.808 175.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -45.45 57.97 Favored 'General case' 0 CA--C 1.506 -0.75 0 C-N-CA 125.95 1.7 . . . . 0.0 109.284 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -35.73 80.91 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 119.639 -0.825 . . . . 0.0 109.72 175.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 48.0 mt -77.69 -13.61 59.85 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 119.079 -0.486 . . . . 0.0 111.86 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.2 t -76.48 -60.82 2.18 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 126.012 1.725 . . . . 0.0 108.215 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -2.52 14.32 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 177.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . 0.474 ' CE3' ' CD1' ' A' ' 525' ' ' ILE . 1.3 t90 -49.49 115.75 1.47 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 123.456 0.703 . . . . 0.0 109.962 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.09 2.76 35.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.925 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -54.87 -23.83 20.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 118.776 0.717 . . . . 0.0 112.411 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . 0.474 ' CD1' ' CE3' ' A' ' 522' ' ' TRP . 0.0 OUTLIER -109.68 -53.73 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 127.469 2.308 . . . . 0.0 109.493 178.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.28 47.61 5.63 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.627 1.571 . . . . 0.0 111.159 -178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -161.11 151.05 17.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -174.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 -33.44 7.2 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.968 1.707 . . . . 0.0 113.021 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.96 -60.48 2.34 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 126.492 1.917 . . . . 0.0 109.456 177.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 87.2 mt -55.26 -29.39 23.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 117.071 -1.443 . . . . 0.0 107.173 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -46.9 -55.07 8.65 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.256 1.389 . . . . 0.0 111.514 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -56.4 -43.99 79.84 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.193 0.906 . . . . 0.0 110.23 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -48.35 79.43 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.372 177.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 40.2 m -64.14 -31.15 72.24 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.358 1.863 . . . . 0.0 108.281 -177.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . 0.46 ' CE1' HD21 ' A' ' 454' ' ' LEU . 41.5 t80 -69.25 -59.28 3.12 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 124.853 1.261 . . . . 0.0 109.807 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -58.38 -40.16 81.57 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.493 178.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.57 -45.19 92.58 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 118.577 0.626 . . . . 0.0 112.151 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.9 t -67.48 -50.95 56.72 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 117.6 -1.191 . . . . 0.0 110.385 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -44.79 72.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.981 1.712 . . . . 0.0 108.567 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.88 -38.69 92.01 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 124.721 1.263 . . . . 0.0 110.532 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -72.42 -39.41 67.9 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 119.146 0.885 . . . . 0.0 109.051 -176.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -59.85 4.43 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 126.198 1.799 . . . . 0.0 107.462 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -54.54 -46.47 73.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 125.014 1.446 . . . . 0.0 110.055 -179.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -56.97 -48.89 77.32 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.078 0.951 . . . . 0.0 109.254 178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -47.59 67.22 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.8 -45.77 88.16 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.219 -0.3 . . . . 0.0 110.359 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -37.02 73.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.495 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -63.06 -50.15 71.71 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.89 1.276 . . . . 0.0 109.519 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 1.4 mt -60.77 -48.45 81.75 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -57.13 -52.99 63.08 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.731 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -50.19 -54.05 23.62 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.725 1.21 . . . . 0.0 108.748 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -58.3 -39.26 78.86 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-O 117.832 -1.08 . . . . 0.0 109.832 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.43 -39.1 75.48 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 120.031 1.287 . . . . 0.0 112.629 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.38 -51.9 57.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 176.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 28.2 mm -65.65 -36.28 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 123.528 1.632 . . . . 0.0 113.115 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -59.84 -28.58 67.61 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 120.519 -1.363 . . . . 0.0 109.973 174.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.01 14.0 33.37 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 125.047 1.339 . . . . 0.0 110.983 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -100.64 -41.68 6.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 118.987 0.812 . . . . 0.0 109.182 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -79.48 -14.76 58.68 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.316 -0.865 . . . . 0.0 111.169 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 72.3 p -101.11 -88.51 0.37 Allowed 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -174.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -51.27 48.51 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 125.184 1.552 . . . . 0.0 108.312 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 89.76 79.49 1.34 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.609 1.576 . . . . 0.0 109.243 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.21 159.34 0.02 OUTLIER 'General case' 0 C--N 1.346 0.431 0 C-N-CA 127.012 2.125 . . . . 0.0 110.867 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.1 p -59.4 163.02 4.27 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 122.439 1.114 . . . . 0.0 109.776 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.96 -42.16 72.02 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 110.742 173.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -62.59 -46.74 86.94 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.365 1.066 . . . . 0.0 110.102 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -64.26 -34.21 77.59 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.178 0.513 . . . . 0.0 111.051 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -37.96 88.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 121.165 -0.96 . . . . 0.0 110.64 176.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.48 -44.34 78.77 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 117.657 -1.163 . . . . 0.0 108.905 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.72 -37.11 58.61 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 118.768 0.713 . . . . 0.0 110.52 179.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 2.1 mt -60.51 -51.54 69.0 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 115.57 -2.157 . . . . 0.0 112.154 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -45.97 -49.94 15.33 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 121.621 2.009 . . . . 0.0 109.536 174.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.95 -32.63 74.44 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.192 1.397 . . . . 0.0 110.628 -177.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -76.43 -43.05 41.88 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.532 1.133 . . . . 0.0 109.255 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.46 -46.53 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 119.253 -2.155 . . . . 0.0 108.6 -176.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.99 71.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.808 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -44.08 81.17 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.093 1.757 . . . . 0.0 107.89 -175.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 13.0 mt . . . . . 0 CA--C 1.516 -0.354 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.545 178.222 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.76 -39.17 90.77 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.762 -1.589 . . . . 0.0 111.692 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.8 mm -61.27 -53.18 52.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . 0.529 ' HG ' ' HG ' ' A' ' 538' ' ' SER . 13.6 mt -60.07 -45.75 91.86 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.458 1.026 . . . . 0.0 111.282 -175.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.55 -54.06 29.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.74 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -60.8 -32.1 78.08 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 119.741 1.155 . . . . 0.0 112.538 -175.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.29 -47.83 63.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 117.677 0.739 . . . . 0.0 109.392 173.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -59.9 -28.05 67.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.489 0.715 . . . . 0.0 111.001 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 40.0 t -68.33 -57.23 9.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.197 0 O-C-N 121.047 -1.033 . . . . 0.0 108.959 173.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.56 -18.48 61.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.735 -0.603 . . . . 0.0 111.665 -174.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -142.53 83.41 11.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 126.483 1.913 . . . . 0.0 109.623 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -70.79 -13.63 32.24 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 121.264 1.309 . . . . 0.0 112.975 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -68.51 -14.26 62.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.755 1.161 . . . . 0.0 110.464 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 67.0 mt -63.4 -13.6 41.45 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.157 -0.965 . . . . 0.0 109.584 173.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.41 -24.31 67.59 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.121 -0.987 . . . . 0.0 110.929 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.8 m -83.64 -13.99 52.95 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.234 0.924 . . . . 0.0 110.908 173.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.7 mt -94.8 -14.22 24.88 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.333 1.053 . . . . 0.0 112.047 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 9.5 p -91.21 142.83 27.55 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 120.411 1.459 . . . . 0.0 108.869 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -68.61 170.67 14.63 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.05 13.07 0.15 Allowed 'Trans proline' 0 CA--C 1.554 1.512 0 C-N-CA 124.924 3.749 . . . . 0.0 115.213 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 1.5 mm? 72.08 46.01 0.36 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.668 2.787 . . . . 0.0 113.359 173.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.39 -83.32 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.714 2.005 . . . . 0.0 111.694 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.13 -2.38 12.82 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 119.882 -1.761 . . . . 0.0 113.48 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.8 -76.62 0.14 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.256 1.823 . . . . 0.0 108.214 -175.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 57.1 t0 62.25 131.71 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 124.139 1.923 . . . . 0.0 113.042 -177.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.47 -20.32 65.48 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.995 1.718 . . . . 0.0 110.394 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -73.08 -33.5 65.66 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.731 1.212 . . . . 0.0 110.456 174.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -80.67 -39.35 27.42 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.418 1.463 . . . . 0.0 111.812 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -119.09 118.22 32.94 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.96 2.74 2.84 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.136 1.891 . . . . 0.0 113.576 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -114.9 0.63 22.94 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 118.064 -1.409 . . . . 0.0 111.892 174.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.48 -47.91 79.84 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 119.158 1.479 . . . . 0.0 108.138 176.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -51.53 -49.37 46.27 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 118.765 0.711 . . . . 0.0 112.116 -176.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.43 -47.29 86.72 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.695 -0.886 . . . . 0.0 110.732 177.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -65.1 -39.55 93.31 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.249 0.62 . . . . 0.0 111.214 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -60.75 -53.22 60.05 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 126.544 1.938 . . . . 0.0 108.378 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -58.45 -40.99 84.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.857 0.723 . . . . 0.0 110.04 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -57.5 11.9 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.99 0.516 . . . . 0.0 111.704 174.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 72.8 t -60.09 -43.8 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 123.859 0.864 . . . . 0.0 110.205 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -57.59 -49.47 76.3 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.321 1.848 . . . . 0.0 109.245 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 96.7 m -58.95 -42.34 89.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.861 1.264 . . . . 0.0 110.758 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.92 -45.0 87.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.524 0.602 . . . . 0.0 109.802 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.89 -23.01 67.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.912 0.885 . . . . 0.0 112.226 174.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 6.1 t -86.28 -11.63 51.73 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.247 1.819 . . . . 0.0 113.45 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -133.22 75.47 70.84 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.19 1.796 . . . . 0.0 108.6 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.69 125.27 14.03 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.643 1.562 . . . . 0.0 109.586 -178.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 93.77 9.44 59.84 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.169 -175.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 1.7 tt -62.44 155.14 26.24 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.842 1.321 . . . . 0.0 108.24 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' THR . . . . . 0.433 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.1 p -127.21 169.8 13.09 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 123.85 0.86 . . . . 0.0 110.003 -173.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -50.01 -51.77 39.3 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.323 1.449 . . . . 0.0 109.962 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.22 -38.71 28.81 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -175.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.433 ' HB3' ' H ' ' A' ' 499' ' ' THR . 9.0 tp-100 -63.93 -25.77 68.29 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.73 -0.652 . . . . 0.0 110.728 179.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 18.7 tp -63.48 -44.4 94.53 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.417 1.008 . . . . 0.0 111.014 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -65.57 -40.8 93.18 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -63.7 -38.3 90.58 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -70.91 -20.67 62.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.092 -1.005 . . . . 0.0 112.947 -179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -106.72 11.94 29.73 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.464 1.106 . . . . 0.0 109.682 174.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.0 ttt180 -56.52 128.71 37.5 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 120.33 -1.481 . . . . 0.0 111.005 -174.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.23 5.93 86.81 Favored Glycine 0 CA--C 1.535 1.291 0 CA-C-O 118.495 -1.17 . . . . 0.0 113.502 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 52.6 m -93.93 147.18 23.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 119.59 1.695 . . . . 0.0 107.382 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -59.4 -17.71 32.75 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 120.691 -1.256 . . . . 0.0 113.328 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -92.96 -19.47 21.58 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-O 117.756 -1.116 . . . . 0.0 110.973 177.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -46.27 -50.09 16.54 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.64 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.88 -45.3 64.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 0.0 112.178 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 25.8 m -58.42 -49.66 76.48 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.972 -0.537 . . . . 0.0 110.669 173.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.6 -35.76 79.59 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 123.788 0.835 . . . . 0.0 111.516 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.13 -47.61 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.911 2.084 . . . . 0.0 107.611 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.26 -29.88 70.11 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 117.509 -1.234 . . . . 0.0 112.213 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 81.8 mt -89.44 -10.86 44.83 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.51 1.05 . . . . 0.0 112.263 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 18.3 t -77.64 -54.08 6.81 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.454 1.502 . . . . 0.0 109.819 174.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.78 19.1 1.76 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.751 1.221 . . . . 0.0 112.571 -178.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -74.95 102.23 4.72 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 116.816 2.154 . . . . 0.0 116.816 -172.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -3.74 18.65 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 129.755 3.222 . . . . 0.0 113.693 178.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.91 -20.39 52.96 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.138 -0.976 . . . . 0.0 111.379 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.12 -63.28 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 126.01 1.724 . . . . 0.0 109.701 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 46.27 25.12 0.33 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.807 2.043 . . . . 0.0 115.889 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -126.23 177.11 6.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.036 1.335 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.32 -21.66 2.29 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.32 1.448 . . . . 0.0 112.982 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -88.22 -56.95 3.11 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.751 2.02 . . . . 0.0 108.036 174.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 43.1 mt -58.51 -31.37 43.31 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -51.32 -54.17 28.76 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 118.651 0.66 . . . . 0.0 112.251 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.77 -45.98 84.07 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.312 0.505 . . . . 0.0 109.91 -177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.15 -44.74 94.74 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.108 0.563 . . . . 0.0 110.972 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 96.8 m -69.1 -30.81 69.18 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.503 176.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -62.13 -55.15 31.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 120.879 1.672 . . . . 0.0 108.698 174.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.6 m -60.36 -41.41 93.63 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.055 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.97 -47.32 78.01 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.919 0.781 . . . . 0.0 111.929 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' SER . . . . . 0.529 ' HG ' ' HG ' ' A' ' 454' ' ' LEU . 46.5 t -61.21 -50.01 74.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.499 1.52 . . . . 0.0 111.536 177.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.42 -49.48 72.3 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.152 1.381 . . . . 0.0 110.138 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -58.62 -46.08 87.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 118.193 -0.908 . . . . 0.0 109.735 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -62.34 -40.29 95.89 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 119.313 0.961 . . . . 0.0 110.667 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -52.73 64.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -63.22 -45.6 90.9 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.671 0.788 . . . . 0.0 111.296 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -52.46 -49.04 65.44 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.764 2.426 . . . . 0.0 109.477 175.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 10.7 t -60.7 -41.36 95.03 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.146 0.579 . . . . 0.0 111.9 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.76 -34.74 77.41 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.681 -1.262 . . . . 0.0 110.788 178.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.82 -39.72 72.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.271 1.428 . . . . 0.0 110.551 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.06 -48.01 77.89 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.231 1.412 . . . . 0.0 108.865 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.6 -48.03 80.53 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 123.473 0.709 . . . . 0.0 109.575 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -62.26 -42.04 98.98 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.739 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -55.41 -50.08 70.69 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 118.604 -0.713 . . . . 0.0 110.104 173.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.16 90.07 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 119.448 1.022 . . . . 0.0 109.549 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -66.36 -35.89 81.5 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.267 0.556 . . . . 0.0 110.202 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.282 0.2 OUTLIER -77.15 -39.64 48.43 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.332 1.053 . . . . 0.0 111.028 176.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.1 mm -66.59 -33.16 61.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 120.965 1.711 . . . . 0.0 108.791 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.05 71.79 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.296 -1.503 . . . . 0.0 110.045 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 13.3 mtp-105 -74.01 -8.24 55.38 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 117.043 -1.456 . . . . 0.0 111.957 173.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -61.82 1.82 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 123.144 2.702 . . . . 0.0 111.77 174.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -68.04 -18.66 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.108 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 75.1 p -95.98 -88.52 0.27 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -66.7 -56.93 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.575 1.15 . . . . 0.0 112.343 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 127.21 121.26 2.42 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.542 1.544 . . . . 0.0 110.557 -174.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.93 150.9 37.43 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.442 1.121 . . . . 0.0 112.013 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 35.4 t -78.14 164.59 24.84 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.789 1.635 . . . . 0.0 108.231 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.96 -42.04 99.71 Favored 'General case' 0 C--O 1.226 -0.164 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -69.64 -50.43 44.28 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 -176.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -60.49 -33.82 73.15 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.86 -0.525 . . . . 0.0 111.382 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . 0.441 ' HA ' HD12 ' A' ' 571' ' ' LEU . 52.9 ttt85 -66.22 -34.21 77.5 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.301 -0.875 . . . . 0.0 109.974 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 80.9 mt -73.09 -34.33 66.14 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.638 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -53.92 -36.43 62.74 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.328 0.967 . . . . 0.0 109.305 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 568' ' ' ARG . 6.3 mt -61.71 -39.32 91.08 Favored 'General case' 0 CA--C 1.519 -0.222 0 O-C-N 120.822 -1.174 . . . . 0.0 112.426 175.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -45.88 91.17 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.037 1.744 . . . . 0.0 108.148 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 3.7 m -66.37 -49.55 66.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 123.81 0.694 . . . . 0.0 109.285 -174.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 6.2 tp -55.1 -43.35 73.91 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.171 1.788 . . . . 0.0 111.286 175.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -64.56 -39.34 93.57 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.903 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -73.37 -34.15 65.42 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.649 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -67.04 -37.19 83.65 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 119.407 1.003 . . . . 0.0 109.469 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--O 1.242 0.691 0 O-C-N 120.487 -1.383 . . . . 0.0 109.718 -178.975 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 mtm . . . . . 0 CA--C 1.542 0.672 0 CA-C-O 121.914 0.864 . . . . 0.0 111.626 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -112.06 -55.12 2.55 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 124.698 1.199 . . . . 0.0 108.464 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.7 mm -56.76 -46.81 83.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -54.51 -55.12 32.35 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.378 0.99 . . . . 0.0 110.356 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 23.2 mt -65.34 -49.04 80.86 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.933 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.2 -38.88 96.35 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 124.048 0.833 . . . . 0.0 111.929 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.1 mt -66.37 -45.15 81.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -34.45 71.26 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.99 0.916 . . . . 0.0 111.871 174.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.23 -53.9 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 124.913 1.285 . . . . 0.0 109.942 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -80.63 -20.94 42.02 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 122.141 -0.35 . . . . 0.0 111.32 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -130.07 81.05 69.75 Favored Pre-proline 0 C--N 1.323 -0.549 0 C-N-CA 124.001 0.921 . . . . 0.0 108.993 -173.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.56 -22.54 64.93 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.994 1.796 . . . . 0.0 111.21 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.16 -22.58 62.96 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.155 0.982 . . . . 0.0 110.686 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.67 -12.11 31.3 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.7 -1.25 . . . . 0.0 111.362 173.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.05 68.09 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 120.907 -1.12 . . . . 0.0 111.209 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 31.9 m -83.65 -21.83 32.34 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.904 0.882 . . . . 0.0 110.906 173.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -14.8 47.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.777 0.717 . . . . 0.0 112.773 175.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 5.7 p -77.79 145.48 70.66 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 120.166 1.348 . . . . 0.0 109.21 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -68.67 170.43 15.24 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.513 2.809 . . . . 0.0 111.483 173.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -74.46 12.92 0.99 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.413 2.742 . . . . 0.0 114.277 175.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 6.6 mp 72.46 43.07 0.5 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.153 2.181 . . . . 0.0 112.698 174.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -65.81 -30.76 71.44 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -126.06 17.41 7.85 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.566 1.546 . . . . 0.0 110.536 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.408 ' HG ' ' CZ ' ' A' ' 543' ' ' PHE . 61.3 mt -100.85 -101.68 0.25 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.246 1.019 . . . . 0.0 109.173 178.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.3 t0 70.97 147.15 0.07 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 128.141 2.577 . . . . 0.0 109.979 -173.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.85 -25.85 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.844 1.658 . . . . 0.0 109.622 173.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.16 -33.55 71.04 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 122.969 0.508 . . . . 0.0 111.229 175.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -92.38 -24.33 18.93 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 112.26 0.466 . . . . 0.0 112.26 176.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.84 96.15 38.36 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -177.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.16 67.31 4.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.579 2.852 . . . . 0.0 111.394 -174.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 163.52 -23.33 0.18 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 127.019 2.247 . . . . 0.0 112.308 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.1 tp -60.66 -23.98 65.23 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.633 -0.922 . . . . 0.0 110.814 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -49.07 -35.26 18.46 Favored Glycine 0 C--O 1.222 -0.655 0 CA-C-N 119.136 0.88 . . . . 0.0 111.326 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.16 -43.44 98.87 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.72 1.26 . . . . 0.0 111.337 174.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.33 -51.25 61.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 124.572 1.149 . . . . 0.0 110.845 176.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -53.84 -50.6 65.85 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.596 0.634 . . . . 0.0 111.12 -178.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -50.91 69.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 117.851 0.296 . . . . 0.0 110.964 174.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.1 -45.61 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.264 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -55.61 -46.37 77.34 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.324 1.05 . . . . 0.0 109.353 -176.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 95.5 m -61.67 -46.77 88.29 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.178 2.191 . . . . 0.0 110.654 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 69.4 m -63.14 -44.16 96.33 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.155 0.889 . . . . 0.0 110.321 -178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -23.18 64.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.105 1.362 . . . . 0.0 112.085 174.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.28 -51.23 8.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.169 1.388 . . . . 0.0 110.293 177.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -71.3 100.48 0.3 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 127.062 2.145 . . . . 0.0 110.504 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.43 115.01 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.287 2.658 . . . . 0.0 111.574 -173.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.58 34.01 54.76 Favored Glycine 0 CA--C 1.522 0.478 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.252 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 15.9 tp -54.74 154.43 5.06 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.643 0.735 . . . . 0.0 110.242 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.96 163.98 26.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.2 1.4 . . . . 0.0 108.565 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -52.76 -45.32 67.01 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.911 0.884 . . . . 0.0 110.583 175.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -80.24 -31.96 36.62 Favored Glycine 0 C--N 1.338 0.691 0 CA-C-O 118.899 -0.945 . . . . 0.0 111.081 -176.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -40.24 95.71 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 118.363 1.081 . . . . 0.0 108.751 174.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 16.5 tp -52.93 -53.08 54.75 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.906 0.776 . . . . 0.0 109.562 177.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.69 -40.72 84.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.102 0.41 . . . . 0.0 111.661 176.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.14 -40.14 96.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.759 0.423 . . . . 0.0 111.078 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -67.4 -20.57 65.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.359 1.464 . . . . 0.0 111.646 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -108.15 17.54 22.17 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.695 1.598 . . . . 0.0 109.217 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 15.5 ttt180 -59.7 133.88 56.5 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 119.901 -1.749 . . . . 0.0 110.166 -175.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 63.43 18.71 61.38 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 121.712 -0.618 . . . . 0.0 113.256 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 44.7 m -93.12 140.79 29.13 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -20.45 16.73 Favored 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -94.16 -19.5 20.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.068 1.347 . . . . 0.0 109.715 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -47.98 -45.53 31.65 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -53.75 -43.81 69.44 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.949 1.3 . . . . 0.0 112.1 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.5 m -62.85 -49.82 73.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.562 0.745 . . . . 0.0 109.042 173.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.1 mt -62.16 -35.73 79.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.404 1.081 . . . . 0.0 112.558 -178.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -34.29 62.07 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.583 2.353 . . . . 0.0 108.75 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.2 -43.31 98.51 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 173.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 24.4 mt -71.17 -22.39 62.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.548 1.139 . . . . 0.0 110.626 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 41.1 t -62.34 -53.99 46.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 120.744 1.611 . . . . 0.0 109.496 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.82 20.28 4.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.875 1.27 . . . . 0.0 111.397 -175.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -70.57 126.76 30.52 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.386 0.674 . . . . 0.0 111.324 -173.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.05 -2.45 37.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.06 1.344 . . . . 0.0 111.424 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -68.74 -27.68 66.14 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.818 -1.176 . . . . 0.0 111.988 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.82 -67.32 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 C-N-CA 126.026 1.731 . . . . 0.0 107.974 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 37.94 52.02 1.46 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.586 1.554 . . . . 0.0 112.14 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -148.27 167.84 24.09 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.947 1.299 . . . . 0.0 109.464 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -120.63 -32.41 4.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.091 2.156 . . . . 0.0 111.597 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -83.38 -55.05 4.54 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.261 1.424 . . . . 0.0 109.413 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.92 -25.89 39.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.9 -54.03 44.35 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.134 174.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -57.83 -46.03 85.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.19 0.995 . . . . 0.0 110.67 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -66.55 -46.92 74.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.767 -0.583 . . . . 0.0 110.104 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 41.6 m -62.25 -28.05 69.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.513 1.525 . . . . 0.0 110.453 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -66.23 -57.66 7.08 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 120.957 1.708 . . . . 0.0 108.641 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 17.8 m -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.346 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -63.91 -46.81 83.15 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.452 1.024 . . . . 0.0 111.758 177.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 29.3 t -65.72 -48.74 70.94 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.032 1.333 . . . . 0.0 110.59 177.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.4 tt -55.27 -52.4 63.54 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-O 117.544 -1.217 . . . . 0.0 109.031 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -59.99 -40.19 88.33 Favored 'General case' 0 C--O 1.214 -0.798 0 O-C-N 124.04 0.838 . . . . 0.0 109.927 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -66.34 -32.8 74.42 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.492 1.042 . . . . 0.0 110.395 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 2.3 ttm -66.92 -58.99 3.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.408 ' CZ ' ' HG ' ' A' ' 474' ' ' LEU . 25.7 m-85 -57.88 -45.16 86.8 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.906 1.283 . . . . 0.0 110.166 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -55.6 -50.52 69.9 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.245 1.818 . . . . 0.0 109.513 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 5.0 t -57.97 -42.09 84.29 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 118.552 0.615 . . . . 0.0 110.187 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 17.6 mt -72.57 -35.2 67.89 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.371 0.987 . . . . 0.0 110.519 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 26.5 mt -67.95 -40.0 83.34 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.241 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -62.19 -58.33 8.17 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 126.242 1.817 . . . . 0.0 108.379 174.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.98 -54.83 40.04 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.768 1.627 . . . . 0.0 109.814 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -49.85 76.16 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 124.88 1.272 . . . . 0.0 110.1 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -49.59 -56.02 11.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 116.245 -1.836 . . . . 0.0 108.656 173.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -60.3 -35.41 75.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.266 1.393 . . . . 0.0 109.956 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -44.81 88.86 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 121.565 -0.709 . . . . 0.0 111.197 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 571' ' ' LEU 0.267 0.0 OUTLIER -80.07 -44.81 19.4 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.372 177.689 . . . . . . . . 4 4 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -39.6 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.942 1.701 . . . . 0.0 108.043 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.76 -39.43 80.95 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.636 -1.29 . . . . 0.0 109.759 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.51 -13.08 18.12 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 116.014 -1.946 . . . . 0.0 110.01 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -58.04 3.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 122.306 2.321 . . . . 0.0 109.256 173.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -63.59 -27.69 69.42 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' THR . . . . . 0.409 HG21 ' H ' ' A' ' 561' ' ' HIS . 1.6 t -99.6 -82.4 0.44 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . 0.409 ' H ' HG21 ' A' ' 560' ' ' THR . 1.6 t-80 -58.48 -40.95 84.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.049 -1.432 . . . . 0.0 113.798 -173.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 98.21 119.29 4.01 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -174.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.75 152.48 19.46 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 173.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.2 t -73.05 165.09 25.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -37.54 74.49 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.451 -0.781 . . . . 0.0 111.385 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -75.61 -53.21 8.95 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 124.532 1.145 . . . . 0.0 110.648 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.75 -40.43 83.82 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 118.96 0.8 . . . . 0.0 111.17 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -59.53 -33.61 71.6 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.138 1.335 . . . . 0.0 109.794 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 19.1 mt -72.36 -37.15 68.87 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 116.715 -1.612 . . . . 0.0 110.068 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.77 -41.1 43.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.841 1.655 . . . . 0.0 109.431 174.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . 0.448 HD12 ' CD1' ' A' ' 554' ' ' LEU . 0.8 OUTLIER -68.86 -38.35 79.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.949 -177.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -47.25 74.19 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 119.512 1.051 . . . . 0.0 109.018 173.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -52.55 63.51 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.1 tt -55.43 -36.44 66.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.284 1.434 . . . . 0.0 111.288 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -61.21 -39.76 91.45 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.155 -1.591 . . . . 0.0 111.474 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -78.41 -25.05 45.98 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.857 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -66.99 -38.95 86.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.558 1.143 . . . . 0.0 109.503 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 N--CA 1.475 0.78 0 C-N-CA 124.882 1.273 . . . . 0.0 112.683 173.887 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 53.2 tpp . . . . . 0 CA--C 1.539 0.541 0 CA-C-O 123.711 1.72 . . . . 0.0 110.721 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.01 -51.29 0.23 Allowed 'General case' 0 CA--C 1.486 -1.491 0 CA-C-O 117.007 -1.473 . . . . 0.0 108.848 -175.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 7.4 mm -58.74 -52.6 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 124.946 1.404 . . . . 0.0 107.709 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . 0.409 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 2.7 mt -56.78 -47.13 80.87 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 118.74 0.7 . . . . 0.0 110.75 -175.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 26.5 mt -62.22 -59.31 4.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 C-N-CA 123.851 0.86 . . . . 0.0 111.606 174.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.85 -38.14 96.04 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 120.833 1.651 . . . . 0.0 113.233 -173.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 47.2 mt -68.9 -38.16 79.44 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.776 173.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -65.96 -36.02 82.2 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.771 1.169 . . . . 0.0 109.86 173.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.7 t -60.91 -51.6 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 O-C-N 120.561 -1.337 . . . . 0.0 109.041 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.25 -20.24 55.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.719 0.807 . . . . 0.0 112.067 177.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -134.53 74.69 65.2 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 119.031 0.832 . . . . 0.0 109.316 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -68.31 -18.52 44.5 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.575 1.516 . . . . 0.0 112.119 -175.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -65.84 -15.06 62.55 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.693 1.197 . . . . 0.0 110.857 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.31 -12.28 61.48 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 120.437 -1.415 . . . . 0.0 109.01 173.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -58.82 -44.73 90.93 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.944 0.793 . . . . 0.0 109.195 173.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.6 m -70.3 -24.73 63.08 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.642 -1.286 . . . . 0.0 112.979 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.2 mt -83.92 -6.02 59.33 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.222 1.809 . . . . 0.0 111.393 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -93.82 157.87 37.38 Favored Pre-proline 0 CA--C 1.547 0.854 0 CA-C-N 121.041 1.746 . . . . 0.0 107.062 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -74.69 174.68 12.25 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.199 2.599 . . . . 0.0 111.076 173.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.58 8.73 2.14 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 124.777 3.651 . . . . 0.0 114.215 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 2.2 mm? 63.69 55.22 1.72 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 129.367 3.067 . . . . 0.0 111.919 178.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.22 -39.71 11.39 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.699 0.8 . . . . 0.0 112.383 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -84.22 6.9 20.92 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 120.687 -1.258 . . . . 0.0 113.851 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' LEU . . . . . 0.451 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 1.5 mp -128.66 -71.41 0.64 Allowed 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 125.569 1.547 . . . . 0.0 109.622 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 6.5 t70 60.71 162.61 0.06 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-O 122.909 1.338 . . . . 0.0 112.311 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -74.81 -14.63 60.71 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 120.569 -1.332 . . . . 0.0 111.107 178.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -63.28 -42.39 99.09 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.766 1.226 . . . . 0.0 109.752 174.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -49.4 22.15 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 118.941 -1.104 . . . . 0.0 108.328 -176.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.2 118.12 36.11 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.56 -173.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -72.3 -2.08 11.14 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.266 1.978 . . . . 0.0 112.614 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -107.0 -7.55 33.01 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.831 1.205 . . . . 0.0 110.621 173.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.9 tp -63.12 -32.69 74.13 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 116.441 -1.742 . . . . 0.0 108.742 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -52.4 -48.13 55.16 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 124.392 1.058 . . . . 0.0 110.775 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -44.32 97.0 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 121.547 -0.972 . . . . 0.0 111.928 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' PHE . . . . . 0.409 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 32.8 t80 -66.19 -42.53 88.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.271 0.628 . . . . 0.0 110.984 177.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -64.64 -48.21 75.67 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 116.679 -1.629 . . . . 0.0 107.254 -176.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.25 -44.2 97.08 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 125.497 1.519 . . . . 0.0 109.886 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.4 mt -55.47 -53.43 56.38 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.258 0.623 . . . . 0.0 111.005 176.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 48.4 t -60.59 -46.78 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 116.214 -1.851 . . . . 0.0 110.361 174.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.03 -45.9 82.78 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 121.938 2.154 . . . . 0.0 110.361 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.8 m -62.34 -47.44 84.19 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 126.469 1.908 . . . . 0.0 109.2 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.7 m -60.28 -38.58 84.03 Favored 'General case' 0 CA--C 1.555 1.152 0 CA-C-N 119.182 0.901 . . . . 0.0 111.854 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.33 -21.26 61.83 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 129.058 2.943 . . . . 0.0 111.517 175.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 23.5 t -89.45 -64.82 1.09 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' GLN . . . . . 0.575 HE22 ' CD2' ' A' ' 506' ' ' HIS . 0.3 OUTLIER -57.2 98.4 0.15 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 125.437 1.495 . . . . 0.0 114.124 -173.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -70.48 127.85 14.58 Favored 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.155 1.903 . . . . 0.0 109.963 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 59.77 42.89 98.23 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 10.9 tp -56.26 159.53 3.47 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.398 1.094 . . . . 0.0 109.009 174.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.4 163.48 22.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.3 m -53.02 -44.5 67.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.781 1.232 . . . . 0.0 109.514 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -73.58 -41.91 42.08 Favored Glycine 0 N--CA 1.442 -0.911 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -58.93 -31.38 68.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 124.626 1.17 . . . . 0.0 111.849 -176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 35.4 tp -64.64 -57.35 9.29 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 174.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.36 -33.17 70.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.236 0.471 . . . . 0.0 112.062 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.04 -48.46 65.57 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.497 1.119 . . . . 0.0 109.805 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' HIS . . . . . 0.575 ' CD2' HE22 ' A' ' 495' ' ' GLN . 68.5 t60 -63.29 -16.48 60.43 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.734 0.813 . . . . 0.0 112.417 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -111.94 16.18 20.43 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.269 1.827 . . . . 0.0 108.969 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -54.86 124.51 16.83 Favored 'General case' 0 C--O 1.227 -0.109 0 O-C-N 120.287 -1.508 . . . . 0.0 108.749 -177.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.77 37.48 61.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.821 -0.433 . . . . 0.0 112.03 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 28.9 m -108.61 152.78 24.32 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.781 1.232 . . . . 0.0 108.737 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -59.75 -25.58 64.98 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.369 1.068 . . . . 0.0 110.591 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -92.31 -17.47 24.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 116.02 -1.943 . . . . 0.0 110.181 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.99 59.3 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 120.016 1.28 . . . . 0.0 109.476 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.25 -45.71 83.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.891 0.769 . . . . 0.0 112.701 -179.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 31.1 m -66.93 -44.05 81.67 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.709 -0.62 . . . . 0.0 109.696 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 61.8 mt -59.76 -40.15 87.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.539 1.536 . . . . 0.0 111.607 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.49 -42.76 78.19 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 127.019 2.128 . . . . 0.0 109.216 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -61.43 -36.4 80.26 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.525 -0.734 . . . . 0.0 109.625 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 32.0 mt -82.37 -8.87 59.63 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.978 0.911 . . . . 0.0 112.246 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.9 t -77.5 -56.66 4.35 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 124.956 1.303 . . . . 0.0 108.14 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.8 12.85 1.18 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.947 1.299 . . . . 0.0 113.274 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -68.53 128.44 36.63 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.189 -0.944 . . . . 0.0 110.903 -175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.66 14.89 15.48 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.711 2.405 . . . . 0.0 110.043 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -65.99 -29.5 69.89 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 120.237 -1.54 . . . . 0.0 109.853 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.63 -48.85 8.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 C-N-CA 128.441 2.696 . . . . 0.0 110.363 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.81 34.28 0.41 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.253 2.221 . . . . 0.0 112.576 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -157.93 165.68 34.56 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.821 1.649 . . . . 0.0 108.155 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -114.56 -35.58 4.85 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.508 1.523 . . . . 0.0 109.365 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.25 -50.76 64.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.596 0.758 . . . . 0.0 110.051 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 2.3 mm -62.91 -28.5 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.44 -61.83 2.21 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 119.962 1.255 . . . . 0.0 109.111 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -54.46 -42.55 70.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.865 1.211 . . . . 0.0 110.612 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.05 -55.03 37.44 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 122.691 0.397 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 47.8 m -63.47 -31.71 72.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 117.414 -1.279 . . . . 0.0 109.102 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -63.16 -54.71 33.45 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.09 1.768 . . . . 0.0 107.676 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 90.8 m -59.84 -48.28 82.32 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.525 0.73 . . . . 0.0 109.551 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -58.22 -46.23 86.26 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.992 1.717 . . . . 0.0 111.666 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 13.2 t -69.12 -45.42 70.2 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 126.824 2.05 . . . . 0.0 111.723 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.5 tt -59.76 -47.26 86.37 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 120.098 1.317 . . . . 0.0 110.753 173.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -59.07 -40.06 84.02 Favored 'General case' 0 C--O 1.207 -1.177 0 O-C-N 120.772 -1.205 . . . . 0.0 113.085 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -64.36 -44.29 91.91 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -52.9 63.67 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' PHE . . . . . 0.451 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 2.9 m-85 -62.29 -40.59 96.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.304 1.041 . . . . 0.0 109.523 -175.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -62.21 -53.81 49.95 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.7 t -51.0 -46.33 61.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.404 1.482 . . . . 0.0 110.817 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 80.0 mt -69.01 -39.93 79.0 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 119.399 0.999 . . . . 0.0 111.121 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.31 -37.29 85.04 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.997 -1.478 . . . . 0.0 110.255 174.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.29 -56.32 13.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.789 2.036 . . . . 0.0 107.818 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 15.6 mt -59.34 -47.1 86.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.66 1.584 . . . . 0.0 108.244 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -47.13 72.54 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -50.84 -55.75 15.48 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-O 114.097 -2.859 . . . . 0.0 107.798 175.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.08 -44.31 91.87 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 125.811 1.944 . . . . 0.0 110.21 -174.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -48.31 74.05 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.71 1.204 . . . . 0.0 109.61 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.252 0.2 OUTLIER -66.06 -44.33 84.83 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.818 -1.176 . . . . 0.0 109.207 176.236 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.3 mm -64.25 -38.58 82.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 120.567 1.531 . . . . 0.0 108.334 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.28 -38.73 66.2 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.657 1.983 . . . . 0.0 107.624 174.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -2.15 1.85 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 116.659 -1.639 . . . . 0.0 112.582 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.92 -27.24 30.76 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.625 1.557 . . . . 0.0 111.338 173.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -107.44 -30.28 8.76 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.642 1.11 . . . . 0.0 111.27 -177.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.8 p -77.22 -51.6 10.66 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -114.3 -36.66 4.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.224 1.41 . . . . 0.0 111.829 -176.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 102.96 128.4 6.36 Favored Glycine 0 C--N 1.339 0.727 0 C-N-CA 125.574 1.559 . . . . 0.0 110.124 -173.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 5.0 mt -87.4 153.23 21.6 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 173.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.75 168.52 11.24 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.282 178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -58.14 -41.45 83.74 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -76.08 -53.61 8.08 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 123.276 0.63 . . . . 0.0 109.786 -178.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.78 -36.07 78.06 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.907 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -59.56 -39.08 82.87 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 120.094 1.315 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 1.5 mp -74.94 -38.24 61.8 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 117.531 -1.223 . . . . 0.0 111.99 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -47.52 -40.8 19.57 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 120.244 1.384 . . . . 0.0 107.875 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.12 -34.93 68.96 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 115.971 -1.966 . . . . 0.0 110.978 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -48.29 75.82 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 121.109 1.777 . . . . 0.0 107.886 173.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -26.27 68.22 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 8.0 tt -81.72 -34.08 30.76 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.556 1.542 . . . . 0.0 109.865 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.67 -44.78 92.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.82 1.648 . . . . 0.0 109.317 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -30.09 68.1 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.72 -35.2 67.5 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.429 -174.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 13.9 mt . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 125.39 1.476 . . . . 0.0 112.891 173.989 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 11.8 pttt . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 122.702 1.239 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -103.2 169.6 8.46 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 128.478 2.711 . . . . 0.0 108.211 173.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' THR . . . . . 0.451 ' HG1' ' CG ' ' A' ' 541' ' ' HIS . 44.8 m -45.77 -67.39 0.29 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.986 2.515 . . . . 0.0 111.586 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . 0.262 1.1 m 57.49 175.09 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 122.058 0.932 . . . . 0.0 109.81 -174.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.16 15.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 119.018 -2.301 . . . . 0.0 111.35 174.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . 0.459 ' HB3' ' CH2' ' A' ' 522' ' ' TRP . 16.4 mtt180 -86.27 -50.63 6.81 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 120.234 -1.541 . . . . 0.0 109.362 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 16.0 mm -63.15 -52.45 58.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.1 -42.43 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.486 1.039 . . . . 0.0 111.656 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 68.5 mt -72.96 -58.61 4.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 CA-C-N 118.719 0.691 . . . . 0.0 110.264 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.21 -32.65 60.36 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.344 0.973 . . . . 0.0 112.383 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 64.9 mt -69.14 -49.55 55.93 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 117.527 0.663 . . . . 0.0 109.664 173.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.63 -38.43 75.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.67 0.788 . . . . 0.0 111.346 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.31 -55.43 24.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.069 1.348 . . . . 0.0 109.241 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 2.4 mp0 -70.06 -20.82 63.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 118.823 -0.608 . . . . 0.0 112.43 -178.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -141.58 80.07 16.5 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.712 1.605 . . . . 0.0 110.369 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.81 -15.34 40.51 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.467 1.445 . . . . 0.0 112.897 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -68.14 -18.94 64.76 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.824 1.193 . . . . 0.0 110.214 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 79.6 mt -63.48 -13.37 39.99 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 121.33 -0.856 . . . . 0.0 110.827 173.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.03 -26.48 68.29 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 118.789 0.722 . . . . 0.0 111.115 173.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 90.6 m -82.92 -17.48 43.51 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.595 1.089 . . . . 0.0 110.854 174.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.73 -8.34 50.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.112 0.965 . . . . 0.0 111.375 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 9.9 p -88.47 145.47 35.58 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-N 119.82 1.191 . . . . 0.0 108.488 -178.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.01 170.98 13.17 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.566 2.844 . . . . 0.0 111.484 174.45 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.09 13.95 0.59 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.467 3.445 . . . . 0.0 113.933 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 9.6 mp 64.05 18.35 11.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.645 1.978 . . . . 0.0 115.935 173.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -47.1 -42.22 18.66 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.712 1.605 . . . . 0.0 114.78 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.26 6.59 48.63 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.908 0.883 . . . . 0.0 112.633 -175.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 5.2 mp -115.06 -71.83 0.72 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.662 1.585 . . . . 0.0 108.595 -173.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 16.5 t70 59.97 166.9 0.07 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 123.256 1.503 . . . . 0.0 110.118 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.3 -6.19 59.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 119.688 -1.882 . . . . 0.0 110.605 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -81.91 -44.85 16.26 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.72 1.608 . . . . 0.0 112.021 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -76.36 -21.2 56.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 119.072 -0.489 . . . . 0.0 111.662 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 52.9 mt -125.27 96.5 39.17 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-O 118.141 -0.933 . . . . 0.0 108.692 -178.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.46 78.11 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.792 2.995 . . . . 0.0 111.197 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.96 -17.06 2.37 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.875 2.179 . . . . 0.0 113.834 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 11.6 tp -56.24 -27.43 54.96 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.615 2.207 . . . . 0.0 110.231 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.05 -36.77 9.38 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 118.998 -0.89 . . . . 0.0 112.816 174.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -47.44 81.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.752 1.776 . . . . 0.0 110.276 175.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -59.74 -49.99 75.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.376 1.07 . . . . 0.0 110.658 174.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -61.77 -45.88 91.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.439 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -57.46 -52.84 63.77 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.69 -48.66 74.73 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.851 0.46 . . . . 0.0 112.028 -177.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.79 -49.88 81.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -58.06 -46.37 85.52 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.928 1.291 . . . . 0.0 109.942 -175.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.7 m -62.81 -41.51 99.33 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 126.499 1.92 . . . . 0.0 110.785 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 44.3 m -62.14 -45.35 93.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.388 1.449 . . . . 0.0 110.38 176.15 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -23.91 67.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.983 0.913 . . . . 0.0 112.253 174.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -15.29 53.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.618 1.167 . . . . 0.0 111.535 176.815 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.9 75.82 66.16 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 124.984 1.314 . . . . 0.0 108.776 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.41 121.39 9.35 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.021 1.814 . . . . 0.0 109.474 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 98.47 8.24 54.97 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.375 0.988 . . . . 0.0 113.421 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.01 152.55 36.57 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.435 1.118 . . . . 0.0 108.027 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' THR . . . . . 0.439 ' HG1' ' HB2' ' A' ' 502' ' ' GLN . 7.3 p -134.03 169.53 17.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.151 0.98 . . . . 0.0 109.031 -174.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -49.88 -48.33 51.47 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.607 1.563 . . . . 0.0 111.509 174.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -82.94 -41.45 8.69 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -174.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.439 ' HB2' ' HG1' ' A' ' 499' ' ' THR . 51.4 tp60 -63.6 -24.84 67.97 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.449 1.1 . . . . 0.0 111.296 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 68.4 tp -55.58 -50.3 70.45 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.676 1.19 . . . . 0.0 110.451 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.61 -35.06 79.77 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . 0.463 ' OE1' ' HD3' ' A' ' 508' ' ' ARG . 1.0 OUTLIER -70.98 -31.59 68.18 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 117.85 0.295 . . . . 0.0 110.217 178.541 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -70.12 -20.71 63.16 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -112.57 17.22 19.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.034 1.733 . . . . 0.0 109.751 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . 0.463 ' HD3' ' OE1' ' A' ' 505' ' ' GLU . 6.6 tpt180 -55.13 120.36 6.86 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.785 -1.197 . . . . 0.0 109.98 -174.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.43 18.25 78.13 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 118.641 -1.088 . . . . 0.0 113.542 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.519 HG22 ' H ' ' A' ' 512' ' ' ASN . 30.0 m -92.79 150.59 20.53 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.545 1.672 . . . . 0.0 107.998 -175.443 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -57.72 -20.83 37.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.897 0.856 . . . . 0.0 112.385 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.519 ' H ' HG22 ' A' ' 510' ' ' THR . 11.6 m-20 -93.39 -17.91 22.97 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.819 1.247 . . . . 0.0 109.703 -177.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -54.29 -38.44 65.91 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.208 1.403 . . . . 0.0 110.971 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.1 88.74 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.822 1.192 . . . . 0.0 111.868 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 32.1 m -65.63 -43.16 90.35 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.679 0.792 . . . . 0.0 109.712 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 13.1 mt -66.7 -32.78 74.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.276 0.631 . . . . 0.0 112.09 179.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.19 -44.52 96.42 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.84 1.656 . . . . 0.0 108.413 174.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.37 -37.38 83.16 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 123.714 0.805 . . . . 0.0 109.899 -177.414 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.35 -31.04 38.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.89 1.676 . . . . 0.0 114.277 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.4 t -70.33 -53.85 14.99 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 124.989 1.315 . . . . 0.0 110.53 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -71.24 9.73 0.71 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.782 1.633 . . . . 0.0 114.03 175.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . 0.459 ' CH2' ' HB3' ' A' ' 452' ' ' ARG . 0.8 OUTLIER -78.33 85.61 4.45 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.925 1.29 . . . . 0.0 113.512 -173.451 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -2.63 1.25 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.632 1.973 . . . . 0.0 112.998 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.78 -0.93 10.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.514 1.526 . . . . 0.0 112.503 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -150.17 -63.14 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 127.463 2.305 . . . . 0.0 109.869 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.62 21.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.272 2.629 . . . . 0.0 116.97 173.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -116.75 177.36 4.73 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.5 1.12 . . . . 0.0 110.041 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -135.11 -30.11 1.07 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 126.775 2.03 . . . . 0.0 112.011 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -81.81 -56.28 4.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.319 1.447 . . . . 0.0 109.167 174.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.51 -28.23 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.799 1.24 . . . . 0.0 108.179 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.88 -50.63 65.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.002 0.819 . . . . 0.0 111.718 177.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.53 -49.95 67.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.829 0.74 . . . . 0.0 109.692 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -48.81 73.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.692 0.797 . . . . 0.0 110.916 177.134 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.1 m -66.23 -32.42 73.83 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 118.161 -0.923 . . . . 0.0 109.083 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -63.78 -54.1 40.5 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 120.519 1.509 . . . . 0.0 108.906 178.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 29.8 m -58.89 -45.97 88.97 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.385 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.57 -41.68 98.38 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.974 1.261 . . . . 0.0 112.165 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.6 t -64.21 -49.84 70.42 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.68 1.992 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 3.7 tt -55.51 -50.04 71.01 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 124.65 1.18 . . . . 0.0 108.002 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -55.69 -44.61 77.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.814 0.846 . . . . 0.0 108.812 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . 0.451 ' CG ' ' HG1' ' A' ' 449' ' ' THR . 6.3 t-80 -61.84 -44.47 96.76 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.192 0.905 . . . . 0.0 110.538 179.555 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -51.26 70.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.326 -0.858 . . . . 0.0 108.736 178.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 7.8 m-85 -59.96 -49.33 78.09 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 123.823 0.849 . . . . 0.0 109.883 -178.578 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -50.39 -52.11 40.31 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.481 2.312 . . . . 0.0 110.092 177.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -44.19 91.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.547 1.139 . . . . 0.0 112.132 176.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.37 -39.6 92.51 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 120.888 -1.133 . . . . 0.0 111.355 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 23.9 mt -67.49 -38.72 84.76 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.229 1.412 . . . . 0.0 108.891 176.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.25 -51.19 69.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.621 1.568 . . . . 0.0 109.44 174.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.94 -47.78 81.89 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.91 -45.13 93.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 117.742 -1.123 . . . . 0.0 109.73 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -52.89 56.14 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.393 1.077 . . . . 0.0 109.853 175.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -36.03 82.82 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.166 -177.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -62.03 -43.98 97.68 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 111.491 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 12.2 mt -63.06 -55.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.944 1.298 . . . . 0.0 108.485 178.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.06 -37.26 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.8 66.87 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 120.084 -1.635 . . . . 0.0 111.659 174.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -96.22 0.01 50.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 116.629 -1.653 . . . . 0.0 112.476 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.59 -44.72 11.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 121.406 1.912 . . . . 0.0 110.617 174.319 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 1.1 11.74 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.053 1.341 . . . . 0.0 113.471 -173.63 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.491 ' CG2' ' H ' ' A' ' 561' ' ' HIS . 5.1 t -139.73 -88.74 0.19 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -178.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.491 ' H ' ' CG2' ' A' ' 560' ' ' THR . 0.7 OUTLIER -50.67 -49.64 56.76 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.767 0.827 . . . . 0.0 111.831 -176.876 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.79 87.79 1.38 Allowed Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 107.341 -2.304 . . . . 0.0 107.341 -175.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 163.27 10.59 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 173.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 32.3 p -67.37 170.13 7.84 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.431 -0.793 . . . . 0.0 111.737 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -64.21 -38.08 89.79 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -64.02 -49.66 71.53 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 124.829 1.252 . . . . 0.0 108.624 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.09 -37.22 84.24 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.816 1.644 . . . . 0.0 110.637 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.98 -30.1 70.13 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.311 1.445 . . . . 0.0 112.541 174.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 13.5 mt -78.86 -38.68 37.27 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-O 117.529 -1.224 . . . . 0.0 109.286 173.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -53.27 -42.35 66.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 119.508 1.049 . . . . 0.0 108.463 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 10.4 mt -53.09 -44.77 67.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.714 1.206 . . . . 0.0 112.736 173.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -52.13 67.01 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 120.113 1.324 . . . . 0.0 109.182 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.41 -45.26 92.0 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.886 0.742 . . . . 0.0 109.861 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.17 -39.16 89.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.998 1.319 . . . . 0.0 111.215 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -65.77 -36.39 83.42 Favored 'General case' 0 C--O 1.227 -0.097 0 C-N-CA 123.864 0.866 . . . . 0.0 109.659 177.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -67.91 -38.46 82.97 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 110.664 176.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.27 -36.42 82.93 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.756 0.822 . . . . 0.0 110.273 176.537 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.0 mt -80.64 -22.72 40.26 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.902 0.881 . . . . 0.0 109.762 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -68.44 -17.94 64.32 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.019 0.528 . . . . 0.0 111.843 178.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -147.12 90.55 1.9 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 119.19 0.905 . . . . 0.0 109.346 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.482 0 C-N-CA 124.975 1.31 . . . . 0.0 113.28 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 123.777 1.751 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -104.54 136.57 43.85 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 104.02 -2.585 . . . . 0.0 104.02 -177.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 12.5 m -58.09 164.02 2.55 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 124.191 0.932 . . . . 0.0 110.897 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.3 p -77.61 -33.89 53.6 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 126.247 1.819 . . . . 0.0 112.374 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 69.91 -41.5 0.49 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 128.2 2.6 . . . . 0.0 112.138 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -64.93 -26.41 68.3 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-O 116.066 -1.921 . . . . 0.0 110.112 175.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 15.8 mm -66.6 -52.87 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 O-C-N 125.494 1.746 . . . . 0.0 108.33 174.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -52.97 -45.25 67.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.662 1.119 . . . . 0.0 111.73 -178.731 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 41.5 mt -71.55 -60.82 2.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-O 118.128 -0.939 . . . . 0.0 111.337 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -48.6 -43.51 28.67 Favored Glycine 0 C--O 1.227 -0.344 0 C-N-CA 126.088 1.804 . . . . 0.0 112.841 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.1 mt -66.25 -42.4 88.63 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 116.282 -1.818 . . . . 0.0 108.525 173.556 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.17 -28.62 69.52 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 120.89 1.677 . . . . 0.0 111.502 176.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 31.4 t -66.66 -55.17 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -178.637 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -81.57 -11.52 59.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.015 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -130.5 74.76 79.89 Favored Pre-proline 0 N--CA 1.447 -0.591 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -65.01 -18.79 63.05 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 120.979 1.119 . . . . 0.0 112.197 178.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.18 -19.71 62.37 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.261 -0.899 . . . . 0.0 111.211 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 17.2 mt -69.79 -13.58 62.35 Favored 'General case' 0 N--CA 1.461 0.075 0 CA-C-N 118.593 0.633 . . . . 0.0 111.169 177.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -61.58 -32.84 72.96 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 117.579 0.172 . . . . 0.0 110.965 174.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.3 m -79.04 -21.17 47.25 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.469 -0.769 . . . . 0.0 111.693 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -81.75 -19.26 41.73 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 121.513 -0.742 . . . . 0.0 110.297 174.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . 0.436 HG11 ' CG1' ' A' ' 489' ' ' VAL . 2.2 p -64.31 147.57 96.93 Favored Pre-proline 0 N--CA 1.444 -0.749 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -178.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -74.5 172.77 15.49 Favored 'Trans proline' 0 N--CA 1.434 -1.985 0 C-N-CA 121.492 1.461 . . . . 0.0 109.829 178.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -75.42 4.4 4.98 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 124.172 3.248 . . . . 0.0 112.475 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.9 mp 66.21 68.58 0.44 Allowed 'General case' 0 C--N 1.348 0.537 0 C-N-CA 124.136 0.975 . . . . 0.0 109.132 177.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.98 -70.53 0.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.92 0.866 . . . . 0.0 110.215 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.64 31.17 5.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.732 0.813 . . . . 0.0 109.375 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.515 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.2 OUTLIER -90.26 -89.15 0.16 Allowed 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -177.364 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.7 t70 64.19 158.44 0.09 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.417 1.58 . . . . 0.0 110.324 -178.426 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . 0.438 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 18.1 mt-10 -81.84 -16.26 51.36 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 120.4 -1.438 . . . . 0.0 109.094 173.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.76 -19.93 66.08 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 123.095 1.426 . . . . 0.0 112.801 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -101.27 -26.04 13.77 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 113.977 -1.465 . . . . 0.0 111.447 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 9.5 mt -142.52 116.11 6.38 Favored Pre-proline 0 N--CA 1.442 -0.832 0 O-C-N 124.127 0.892 . . . . 0.0 110.213 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.1 -44.2 13.15 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.269 1.979 . . . . 0.0 109.791 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -79.15 -20.91 68.81 Favored Glycine 0 C--N 1.339 0.697 0 O-C-N 120.396 -1.44 . . . . 0.0 112.117 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -55.14 -37.2 66.65 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 118.003 0.902 . . . . 0.0 110.203 174.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . 0.438 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -51.17 -47.07 50.63 Favored Glycine 0 C--O 1.221 -0.709 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.33 175.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -52.06 -51.97 54.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.039 1.42 . . . . 0.0 111.639 176.5 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -55.84 -51.9 65.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.812 0.845 . . . . 0.0 110.382 175.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.481 HH21 ' CG ' ' A' ' 490' ' ' ASN . 0.0 OUTLIER -59.88 -46.26 89.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.178 0.591 . . . . 0.0 111.372 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -63.2 -47.83 80.88 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 127.026 2.13 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -57.06 -46.12 82.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.257 176.182 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . 0.436 ' CG1' HG11 ' A' ' 468' ' ' VAL . 72.1 t -63.48 -41.95 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 CA-C-O 117.069 -1.443 . . . . 0.0 108.708 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . 0.481 ' CG ' HH21 ' A' ' 486' ' ' ARG . 27.1 t-20 -54.43 -43.03 71.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 120.95 1.704 . . . . 0.0 110.779 -177.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 17.7 m -70.13 -48.35 57.84 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.803 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 72.7 m -59.46 -36.07 75.28 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 118.993 0.815 . . . . 0.0 111.662 177.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.73 -15.19 26.69 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 128.115 2.566 . . . . 0.0 111.583 174.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.3 t -95.57 -57.74 2.3 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-O 116.59 -1.671 . . . . 0.0 108.087 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -57.91 104.24 0.41 Allowed Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.662 1.585 . . . . 0.0 110.469 -175.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -79.24 122.68 5.28 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 123.01 2.474 . . . . 0.0 111.318 -174.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 67.3 33.15 81.59 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 118.623 -1.751 . . . . 0.0 112.71 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 2.9 tp -64.42 148.49 50.39 Favored 'General case' 0 CA--C 1.506 -0.744 0 O-C-N 120.939 -1.33 . . . . 0.0 111.346 179.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.1 p -112.05 169.16 9.04 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.96 1.704 . . . . 0.0 110.135 -177.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.6 m -64.66 -35.51 81.26 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.12 -46.9 33.1 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 108.189 -1.964 . . . . 0.0 108.189 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -43.67 55.72 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.48 -173.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 28.5 tp -52.5 -54.89 26.5 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 118.63 0.65 . . . . 0.0 112.218 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.87 -34.84 65.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.941 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.11 -44.24 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 119.467 1.03 . . . . 0.0 112.23 175.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -68.54 -13.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.453 1.501 . . . . 0.0 111.146 176.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . 0.571 ' CD2' ' CD1' ' A' ' 516' ' ' LEU . 37.3 m-85 -118.36 18.56 13.63 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 125.425 1.49 . . . . 0.0 108.728 178.759 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -58.33 -20.49 43.72 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.795 1.634 . . . . 0.0 112.617 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -137.71 42.48 1.29 Allowed Glycine 0 N--CA 1.438 -1.172 0 C-N-CA 124.454 1.026 . . . . 0.0 111.141 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 51.3 m -105.43 139.57 39.85 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.583 1.191 . . . . 0.0 109.041 178.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.03 -20.5 17.07 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 119.967 -1.708 . . . . 0.0 113.237 175.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -94.53 -16.91 22.89 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 125.8 1.64 . . . . 0.0 112.173 178.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.88 -37.31 2.77 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 125.64 1.576 . . . . 0.0 110.589 175.128 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.79 -60.8 2.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.509 1.524 . . . . 0.0 110.392 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 51.5 m -61.93 -40.75 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.889 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . 0.571 ' CD1' ' CD2' ' A' ' 507' ' ' TYR . 17.4 mt -60.7 -31.34 70.62 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 119.128 0.876 . . . . 0.0 111.171 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.06 -41.53 64.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 122.171 0.986 . . . . 0.0 110.987 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -34.72 78.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.179 174.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 92.1 mt -77.19 -8.86 58.27 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 116.525 -1.702 . . . . 0.0 112.195 174.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.5 t -76.16 -67.67 0.66 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.414 1.886 . . . . 0.0 109.264 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -2.07 8.36 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . 0.426 ' CE3' ' CD1' ' A' ' 525' ' ' ILE . 1.4 t90 -49.37 136.67 15.64 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 123.02 0.528 . . . . 0.0 109.967 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.77 3.24 8.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 124.887 1.275 . . . . 0.0 108.457 -174.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -53.81 -37.78 63.9 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.515 1.15 . . . . 0.0 112.21 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.426 ' CD1' ' CE3' ' A' ' 522' ' ' TRP . 0.0 OUTLIER -93.29 -55.71 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 113.308 -1.769 . . . . 0.0 109.027 179.421 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 45.95 40.07 6.38 Favored 'General case' 0 C--N 1.344 0.343 0 O-C-N 124.612 1.195 . . . . 0.0 110.838 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -159.47 153.21 22.92 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.94 -25.77 10.57 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.722 1.209 . . . . 0.0 111.388 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -82.43 -62.83 1.51 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 124.042 0.937 . . . . 0.0 109.617 177.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 80.1 mt -52.39 -32.89 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -49.11 -58.42 4.99 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.006 175.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -50.34 -42.52 53.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.411 1.459 . . . . 0.0 113.14 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -51.68 63.15 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.795 176.159 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 17.0 m -61.72 -28.49 69.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.364 1.466 . . . . 0.0 110.031 -178.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 82.0 t80 -69.08 -59.75 2.82 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 126.491 1.916 . . . . 0.0 109.816 178.763 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 35.3 m -61.18 -39.81 91.54 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 124.028 0.83 . . . . 0.0 109.259 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -56.86 -45.68 82.31 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.27 0.941 . . . . 0.0 110.195 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 3.6 t -65.18 -49.52 69.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.671 0.788 . . . . 0.0 111.461 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . 0.499 HD23 ' CE1' ' A' ' 543' ' ' PHE . 0.4 OUTLIER -55.4 -43.39 75.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.053 177.41 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.06 -41.21 96.18 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-O 116.166 -1.873 . . . . 0.0 107.46 176.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -68.73 -37.26 79.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 120.782 1.628 . . . . 0.0 109.569 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.8 ttp -62.58 -55.78 24.05 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.817 0.847 . . . . 0.0 110.413 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.515 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 6.3 m-85 -56.06 -45.52 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.367 1.867 . . . . 0.0 110.893 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -59.05 -48.96 79.7 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 126.214 1.806 . . . . 0.0 109.087 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.1 t -56.28 -45.66 80.05 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 6.5 mt -63.16 -46.61 86.37 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.998 -1.064 . . . . 0.0 110.495 -177.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 28.4 mt -60.62 -37.81 82.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.826 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.74 -52.63 35.25 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.632 1.573 . . . . 0.0 109.613 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 14.6 mt -56.28 -45.47 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.309 1.044 . . . . 0.0 108.702 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 35.7 ttt85 -55.15 -54.83 38.32 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.963 175.155 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.4 -55.31 9.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.207 1.567 . . . . 0.0 109.306 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.56 -38.52 81.34 Favored 'General case' 0 N--CA 1.442 -0.858 0 O-C-N 123.71 0.631 . . . . 0.0 109.982 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.74 -40.17 87.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 119.05 0.841 . . . . 0.0 112.818 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 2.4 mt -66.8 -51.1 59.64 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 38.4 mm -64.9 -38.68 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 CA-C-O 122.976 1.369 . . . . 0.0 110.843 -179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.42 65.93 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 119.843 -1.786 . . . . 0.0 109.949 174.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -106.26 11.65 30.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 125.51 1.524 . . . . 0.0 110.732 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -98.93 -29.8 12.73 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.994 1.27 . . . . 0.0 110.641 177.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -22.23 17.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.075 -178.049 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -96.55 -68.88 0.78 Allowed 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.222 1.487 . . . . 0.0 108.14 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -43.69 18.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.352 178.068 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 79.68 79.33 0.84 Allowed Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.9 157.65 0.07 Allowed 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 125.563 1.545 . . . . 0.0 110.743 172.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.16 157.95 7.61 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.597 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -53.07 -43.23 66.56 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.466 175.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.39 -46.74 88.9 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.158 177.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -60.59 -35.43 76.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.3 0.571 . . . . 0.0 111.478 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -37.71 88.53 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.444 -0.785 . . . . 0.0 111.648 175.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -66.55 -41.07 89.25 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-O 117.454 -1.26 . . . . 0.0 109.024 176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -50.91 -38.3 49.18 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.807 0.813 . . . . 0.0 110.966 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 2.0 mt -63.07 -46.59 86.76 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 118.002 -0.999 . . . . 0.0 112.21 176.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -50.68 52.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.711 1.141 . . . . 0.0 108.981 173.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -33.89 73.5 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -176.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -39.79 64.93 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.65 1.58 . . . . 0.0 111.036 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -56.97 -45.46 82.87 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.905 0.882 . . . . 0.0 108.869 174.561 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -66.3 -31.63 72.55 Favored 'General case' 0 C--O 1.189 -2.093 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 175.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . 0.265 0.3 OUTLIER -68.87 -23.08 64.17 Favored 'General case' 0 CA--C 1.497 -1.084 0 C-N-CA 129.72 3.208 . . . . 0.0 115.06 174.336 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.67 -25.88 12.53 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -87.41 55.97 3.75 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 117.861 -3.024 . . . . 0.0 110.809 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 62.75 167.12 0.12 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.718 1.207 . . . . 0.0 111.104 -177.536 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.06 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 118.639 -0.695 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 168.41 6.53 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 4.5 t -131.35 133.87 45.74 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 173.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' THR . . . . . 0.486 ' C ' ' H ' ' A' ' 452' ' ' ARG . 10.2 t -66.52 152.1 45.92 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.285 -0.884 . . . . 0.0 108.973 174.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.9 11.92 0.13 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.645 1.578 . . . . 0.0 111.325 173.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . 0.486 ' H ' ' C ' ' A' ' 450' ' ' THR . 2.9 ttm180 -79.62 -30.47 41.43 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.515 -1.707 . . . . 0.0 109.836 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.5 mm -61.98 -42.47 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 119.92 1.236 . . . . 0.0 109.458 175.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . 0.438 ' CD2' ' HE1' ' A' ' 542' ' ' MET . 4.2 mm? -60.85 -52.75 63.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.644 -173.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 23.0 mt -65.5 -50.37 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 C-N-CA 124.665 1.186 . . . . 0.0 108.123 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -53.59 -50.32 53.94 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 126.074 1.797 . . . . 0.0 113.344 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.493 ' CD2' HD12 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -69.48 -47.41 64.01 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.291 -0.955 . . . . 0.0 109.046 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . 0.566 HD11 ' HG ' ' A' ' 492' ' ' CYS . 3.2 tm? -59.83 -33.22 71.47 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.27 -52.32 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 126.149 1.78 . . . . 0.0 108.434 175.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -76.34 -23.61 54.22 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 122.891 0.476 . . . . 0.0 111.97 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -129.76 74.0 81.04 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 124.79 1.236 . . . . 0.0 110.097 -173.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -61.81 -19.5 65.75 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.282 1.988 . . . . 0.0 111.701 -174.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.87 -17.12 63.94 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.946 1.298 . . . . 0.0 111.607 173.604 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 19.1 mt -63.98 -13.43 46.25 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 120.113 -1.617 . . . . 0.0 109.965 173.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.23 -38.99 92.12 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 88.5 m -71.68 -18.26 62.19 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.001 1.273 . . . . 0.0 112.464 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.1 mt -87.93 -22.13 24.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.578 1.151 . . . . 0.0 112.29 173.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -80.08 146.85 64.09 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.189 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_endo -75.43 174.23 13.15 Favored 'Trans proline' 0 CA--C 1.553 1.426 0 C-N-CA 122.384 2.056 . . . . 0.0 111.494 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -69.34 4.37 2.05 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 125.115 3.877 . . . . 0.0 114.113 175.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 5.5 mp 71.76 55.62 0.19 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.647 2.379 . . . . 0.0 112.442 177.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.86 -25.98 44.01 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 -178.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.29 2.08 10.27 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.714 1.206 . . . . 0.0 112.212 -176.589 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.464 HD22 ' CZ ' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -88.38 -75.99 0.41 Allowed 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 126.008 1.723 . . . . 0.0 106.933 -173.486 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 9.9 t70 63.73 159.03 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 O-C-N 125.452 1.72 . . . . 0.0 112.542 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -93.77 -16.02 24.59 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 119.981 -1.7 . . . . 0.0 110.444 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.69 -22.38 43.49 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.286 2.235 . . . . 0.0 112.383 175.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -16.78 33.22 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 119.081 0.855 . . . . 0.0 111.664 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.44 103.92 6.53 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 123.397 0.679 . . . . 0.0 110.855 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.77 77.84 0.73 Allowed 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.603 3.536 . . . . 0.0 110.004 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.03 -11.08 3.09 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.866 1.698 . . . . 0.0 113.409 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -65.09 -34.31 78.11 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.434 1.617 . . . . 0.0 109.437 173.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.31 -38.47 12.71 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 119.254 0.933 . . . . 0.0 112.875 175.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.29 -55.05 39.74 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 117.791 0.796 . . . . 0.0 109.581 174.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -55.99 -47.43 77.72 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.728 0.811 . . . . 0.0 111.29 177.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -49.38 73.74 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.66 -38.76 80.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.738 1.215 . . . . 0.0 111.407 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.6 -49.72 76.68 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 125.688 1.595 . . . . 0.0 110.436 175.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 69.2 t -60.47 -49.94 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 CA-C-O 117.324 -1.322 . . . . 0.0 107.467 173.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -51.93 -45.48 64.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.121 1.328 . . . . 0.0 109.784 -175.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.9 m -64.1 -49.46 72.16 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 125.095 1.358 . . . . 0.0 110.45 173.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . 0.566 ' HG ' HD11 ' A' ' 458' ' ' LEU . 98.9 m -58.18 -36.95 73.82 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.478 1.49 . . . . 0.0 113.216 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -61.11 -21.68 63.93 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 130.044 3.338 . . . . 0.0 112.156 173.876 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.9 t -93.41 -61.72 1.51 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 174.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 63.8 mm-40 -48.91 91.88 0.04 OUTLIER Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 128.85 2.86 . . . . 0.0 112.206 -173.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -70.66 123.85 10.18 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.336 2.024 . . . . 0.0 111.345 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.07 37.72 94.92 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 22.6 tp -59.37 162.28 4.89 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.786 0.803 . . . . 0.0 110.187 175.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.75 164.32 29.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.024 1.33 . . . . 0.0 107.555 -176.497 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.7 m -52.37 -46.16 66.08 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.934 1.294 . . . . 0.0 110.268 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.24 -44.16 23.49 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.83 -26.9 68.98 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.011 0.925 . . . . 0.0 111.142 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 42.2 tp -60.6 -54.33 46.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.14 -32.72 73.35 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.711 0.805 . . . . 0.0 111.159 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.07 -44.31 80.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.574 1.15 . . . . 0.0 111.243 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -63.93 -18.27 64.06 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.245 1.818 . . . . 0.0 112.638 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -113.13 18.57 17.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 127.29 2.236 . . . . 0.0 111.11 176.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.8 125.07 20.75 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.482 -1.386 . . . . 0.0 109.874 -176.38 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.65 37.55 61.69 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 44.4 m -108.44 151.48 26.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.058 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -61.29 -24.88 66.73 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.846 1.259 . . . . 0.0 110.678 173.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 10.2 m-80 -91.97 -16.91 25.89 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-O 116.979 -1.486 . . . . 0.0 109.909 179.453 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.98 -45.79 51.9 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-N 119.567 1.076 . . . . 0.0 108.661 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.47 -46.13 84.04 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 81.4 m -64.16 -47.59 79.27 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 118.504 -0.76 . . . . 0.0 109.244 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 82.1 mt -58.39 -41.16 84.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.698 1.599 . . . . 0.0 110.79 179.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -41.79 74.43 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 127.155 2.182 . . . . 0.0 109.301 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -62.0 -41.11 97.7 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.373 -1.299 . . . . 0.0 108.533 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 92.8 mt -73.3 -16.55 61.37 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 175.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.7 t -70.4 -36.59 74.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.137 1.375 . . . . 0.0 109.6 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.39 2.74 31.56 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.108 1.763 . . . . 0.0 113.406 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 14.3 t90 -75.7 73.56 2.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.75 1.22 . . . . 0.0 108.693 178.097 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.45 -13.12 47.1 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.243 2.617 . . . . 0.0 111.182 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -52.61 -20.06 2.77 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.254 2.622 . . . . 0.0 113.205 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.493 HD12 ' CD2' ' A' ' 457' ' ' LEU . 54.0 mt -51.81 -69.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 128.813 2.845 . . . . 0.0 111.459 175.26 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -162.7 -94.79 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.77 1.294 . . . . 0.0 110.537 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -152.84 164.56 37.62 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.5 2.72 . . . . 0.0 108.22 -176.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -21.35 64.78 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 120.097 1.317 . . . . 0.0 113.829 174.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.22 -57.42 3.27 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.937 1.695 . . . . 0.0 108.769 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 16.3 mt -71.17 -2.07 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.504 1.522 . . . . 0.0 110.199 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.56 -64.08 0.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.666 1.121 . . . . 0.0 108.258 174.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -55.47 -35.81 65.91 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.827 0.451 . . . . 0.0 111.285 -176.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -51.19 59.36 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 117.346 -1.311 . . . . 0.0 110.473 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 52.6 m -57.96 -36.7 72.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.615 1.966 . . . . 0.0 110.079 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -62.22 -56.01 22.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.464 -0.779 . . . . 0.0 110.75 175.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 52.3 m -62.34 -42.52 99.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.089 -0.958 . . . . 0.0 108.944 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.42 -47.26 82.22 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.87 1.268 . . . . 0.0 110.201 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 8.7 t -66.68 -44.53 81.53 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.164 0.986 . . . . 0.0 110.919 178.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.46 -51.09 68.07 Favored 'General case' 0 C--O 1.202 -1.421 0 C-N-CA 125.157 1.383 . . . . 0.0 108.935 177.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -60.14 -43.94 95.33 Favored 'General case' 0 C--N 1.372 1.564 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -66.36 -38.52 87.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 120.046 -1.659 . . . . 0.0 111.59 -178.027 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' MET . . . . . 0.438 ' HE1' ' CD2' ' A' ' 454' ' ' LEU . 0.5 OUTLIER -64.97 -54.91 23.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.464 ' CZ ' HD22 ' A' ' 474' ' ' LEU . 3.0 m-85 -60.43 -47.39 86.31 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.025 1.33 . . . . 0.0 108.1 -175.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -52.23 -51.93 55.4 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.227 2.211 . . . . 0.0 110.377 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.1 t -51.48 -50.57 59.6 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.482 0.713 . . . . 0.0 111.342 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 55.8 mt -66.19 -40.96 90.8 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.722 1.209 . . . . 0.0 111.374 -174.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.06 -38.7 92.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.651 1.981 . . . . 0.0 109.201 174.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -49.96 54.65 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.488 1.515 . . . . 0.0 109.766 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 13.6 mt -58.23 -45.96 86.77 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.291 1.436 . . . . 0.0 109.586 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -59.96 -46.76 88.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.068 0.947 . . . . 0.0 109.648 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -53.84 -47.73 70.65 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.67 -50.07 73.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.396 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -43.63 81.41 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.423 1.889 . . . . 0.0 110.605 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 11.1 mt -59.25 -52.64 64.8 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.696 1.199 . . . . 0.0 109.365 173.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 33.4 mm -63.62 -34.94 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 121.379 1.899 . . . . 0.0 113.1 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -57.64 -37.5 73.45 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -67.96 2.24 2.18 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 128.593 2.757 . . . . 0.0 112.999 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -94.22 -54.4 3.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 119.809 1.186 . . . . 0.0 111.606 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -72.07 8.57 1.22 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.855 1.262 . . . . 0.0 113.451 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.5 p -124.44 -67.4 0.92 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.11 0.964 . . . . 0.0 110.599 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.59 -68.06 0.82 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.695 1.998 . . . . 0.0 109.181 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 140.02 132.07 2.84 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 126.409 1.957 . . . . 0.0 108.544 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.7 120.47 22.68 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.86 172.93 0.48 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.087 0.946 . . . . 0.0 109.712 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.57 -45.99 90.22 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 121.322 -0.861 . . . . 0.0 109.952 172.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.29 -46.15 67.88 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-O 116.998 -1.477 . . . . 0.0 110.319 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -62.63 -42.71 99.75 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 121.116 1.78 . . . . 0.0 110.262 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -59.48 -37.58 78.59 Favored 'General case' 0 C--N 1.343 0.306 0 O-C-N 120.897 -1.127 . . . . 0.0 110.9 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 39.4 mt -73.48 -39.92 64.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.512 176.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -46.54 56.91 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.649 1.58 . . . . 0.0 107.832 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.1 mt -55.99 -45.89 78.86 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 174.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -47.73 77.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.661 1.119 . . . . 0.0 108.144 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -32.73 73.33 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 118.943 -0.551 . . . . 0.0 111.093 -178.103 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.74 -37.91 82.81 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.701 1.137 . . . . 0.0 110.347 174.035 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -71.58 -31.3 66.8 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 120.409 -1.432 . . . . 0.0 109.801 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -73.31 -25.41 60.64 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.608 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -78.04 -35.0 50.24 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.854 1.661 . . . . 0.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.69 -20.28 46.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.801 1.64 . . . . 0.0 111.911 176.08 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -157.4 -88.12 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.786 -1.197 . . . . 0.0 109.776 175.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -172.7 148.43 1.9 Allowed 'General case' 0 C--O 1.235 0.307 0 C-N-CA 125.069 1.347 . . . . 0.0 109.012 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.4 tttp . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.53 69.79 0.5 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 126.385 1.874 . . . . 0.0 109.89 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 3.8 m -140.64 130.02 23.84 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 119.41 -2.056 . . . . 0.0 107.251 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.0 t -150.07 28.92 0.74 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.278 0.631 . . . . 0.0 110.499 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 1.5 mtt 75.68 -38.83 0.37 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 127.163 2.185 . . . . 0.0 110.604 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -59.98 -30.41 69.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.021 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 1.5 mm -63.7 -52.98 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 120.067 1.303 . . . . 0.0 108.162 174.195 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.87 -52.9 63.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.571 1.078 . . . . 0.0 108.389 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 38.7 mt -66.63 -53.5 34.71 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.082 -176.432 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -55.6 -41.37 81.67 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 128.19 2.805 . . . . 0.0 112.234 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.3 mt -70.92 -36.03 72.51 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 118.073 -0.965 . . . . 0.0 109.399 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -27.97 67.13 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.259 1.391 . . . . 0.0 111.744 173.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 33.6 t -69.24 -56.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 125.089 1.356 . . . . 0.0 107.908 178.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -75.9 -8.51 57.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 20.4 t-20 -146.96 70.65 12.21 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 121.198 -0.939 . . . . 0.0 111.706 -178.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.52 -17.85 60.32 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.832 1.688 . . . . 0.0 111.446 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.91 -22.87 64.14 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 120.343 -1.473 . . . . 0.0 112.352 173.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 49.3 mt -59.84 -14.99 17.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.531 1.06 . . . . 0.0 109.907 173.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.26 -20.57 66.48 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.743 -0.598 . . . . 0.0 112.299 173.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 77.4 m -83.96 -26.19 29.44 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 119.387 0.994 . . . . 0.0 110.254 173.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 28.6 mt -84.98 -14.98 45.81 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.355 -0.84 . . . . 0.0 112.275 175.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 3.0 p -69.41 152.09 96.56 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -73.74 170.63 19.57 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.063 1.842 . . . . 0.0 111.488 173.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -74.51 2.28 6.51 Favored 'Trans proline' 0 CA--C 1.541 0.838 1 C-N-CA 125.533 4.155 . . . . 0.0 113.953 173.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 71.09 65.82 0.17 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.92 2.488 . . . . 0.0 110.854 174.441 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -73.23 -72.98 0.23 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.51 1.124 . . . . 0.0 110.206 -173.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.88 13.72 13.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.665 1.186 . . . . 0.0 112.397 176.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -87.14 -85.52 0.17 Allowed 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 -173.498 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.0 t0 62.47 152.13 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 O-C-N 126.384 2.302 . . . . 0.0 111.944 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -84.31 -18.46 36.24 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 118.678 -2.514 . . . . 0.0 108.896 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -78.3 -9.03 59.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.885 1.674 . . . . 0.0 112.95 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -116.74 5.98 13.2 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.569 1.547 . . . . 0.0 111.186 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.29 163.02 49.02 Favored Pre-proline 0 C--O 1.221 -0.433 0 C-N-CA 126.226 1.81 . . . . 0.0 110.193 -179.051 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -80.89 -67.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 120.867 1.045 . . . . 0.0 112.991 -172.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -128.03 25.06 4.99 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -62.47 -31.22 71.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.051 -0.976 . . . . 0.0 108.565 172.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.09 -38.28 6.09 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-O 118.644 -1.087 . . . . 0.0 111.696 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -55.55 33.33 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.09 1.945 . . . . 0.0 111.728 174.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -53.69 -54.78 33.05 Favored 'General case' 0 C--N 1.337 0.029 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.721 174.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.2 ttp85 -55.61 -46.18 77.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.535 0.734 . . . . 0.0 110.973 -173.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.59 -39.01 70.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.837 1.255 . . . . 0.0 110.719 -175.53 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.5 mt -61.16 -46.28 91.16 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 123.282 0.633 . . . . 0.0 109.862 173.825 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 67.4 t -61.92 -47.85 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-O 118.095 -0.955 . . . . 0.0 108.606 176.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -54.38 -47.23 72.91 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.616 1.566 . . . . 0.0 109.982 -177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' THR . . . . . 0.412 HG21 HE22 ' A' ' 495' ' ' GLN . 89.5 m -63.96 -47.49 80.2 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 126.07 1.748 . . . . 0.0 109.894 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.2 m -60.74 -36.93 80.13 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.213 -2.18 . . . . 0.0 111.923 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.46 -26.82 68.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.939 2.096 . . . . 0.0 111.55 173.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.78 -53.67 7.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.579 1.552 . . . . 0.0 108.345 173.439 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.412 HE22 HG21 ' A' ' 491' ' ' THR . 0.4 OUTLIER -64.06 101.06 0.24 Allowed Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 119.645 1.111 . . . . 0.0 111.883 -175.044 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -63.25 128.73 23.44 Favored 'Trans proline' 0 N--CA 1.439 -1.717 0 N-CA-C 107.329 -1.835 . . . . 0.0 107.329 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.63 48.05 56.7 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 124.374 0.988 . . . . 0.0 113.093 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.6 tp -63.61 155.54 29.39 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.149 0.979 . . . . 0.0 110.272 173.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.0 163.65 29.8 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.568 1.947 . . . . 0.0 108.19 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 86.0 m -51.34 -46.69 62.75 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.182 0.993 . . . . 0.0 110.551 173.733 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.41 -43.89 14.59 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -62.0 -24.2 66.9 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.778 0.831 . . . . 0.0 111.188 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 24.1 tp -67.09 -51.22 57.04 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 123.876 0.87 . . . . 0.0 110.778 176.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.8 mt -61.18 -34.41 75.01 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 122.76 0.424 . . . . 0.0 110.151 173.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.98 -39.29 90.22 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.466 -0.771 . . . . 0.0 112.318 177.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -65.6 -17.84 64.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.615 1.566 . . . . 0.0 112.577 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -117.26 21.37 13.18 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.99 2.116 . . . . 0.0 110.776 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.18 131.2 50.07 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 119.952 -1.718 . . . . 0.0 109.194 -175.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 67.86 31.08 74.93 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 173.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 53.9 m -102.31 148.69 25.15 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.74 -21.66 64.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.797 1.239 . . . . 0.0 111.362 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -92.6 -15.75 26.49 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.463 1.505 . . . . 0.0 111.58 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.78 -47.57 59.62 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.77 61.59 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.232 1.013 . . . . 0.0 113.28 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 30.0 m -66.48 -48.74 68.89 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.116 0.966 . . . . 0.0 110.382 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 65.2 mt -57.06 -39.43 74.9 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.351 1.46 . . . . 0.0 111.961 174.079 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -75.02 -34.3 61.9 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 127.296 2.238 . . . . 0.0 110.923 -177.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -33.98 75.85 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 173.447 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 77.2 mt -78.83 -13.87 59.56 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.953 1.251 . . . . 0.0 114.353 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.5 t -72.86 -60.46 2.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.144 1.378 . . . . 0.0 108.739 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -71.1 0.76 6.92 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.646 1.578 . . . . 0.0 113.973 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.96 111.13 3.18 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 124.257 1.023 . . . . 0.0 111.903 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.53 0.25 47.14 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.59 2.356 . . . . 0.0 110.095 -175.543 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.25 -18.88 60.57 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 125.983 1.713 . . . . 0.0 111.759 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -122.19 -78.58 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 131.26 3.824 . . . . 0.0 109.743 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.3 59.95 4.11 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.151 1.78 . . . . 0.0 111.914 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -153.7 170.78 20.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.853 0.861 . . . . 0.0 110.914 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.22 -32.07 4.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 127.55 2.34 . . . . 0.0 110.911 173.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -84.84 -55.82 3.89 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 120.552 -1.343 . . . . 0.0 109.115 -177.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 63.7 mt -58.05 -27.64 32.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 124.235 1.014 . . . . 0.0 108.56 174.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.91 -59.93 3.62 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 125.168 1.387 . . . . 0.0 109.978 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.28 -42.95 64.16 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.386 0.994 . . . . 0.0 109.75 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -48.65 66.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 89.3 m -61.96 -32.75 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.79 2.036 . . . . 0.0 108.298 177.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 53.9 t80 -64.68 -58.71 5.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 125.496 1.519 . . . . 0.0 109.839 178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -60.0 -43.82 94.95 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.303 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.45 -43.41 68.05 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 120.878 1.672 . . . . 0.0 109.473 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 2.6 t -71.07 -48.23 53.82 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.66 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 176.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -43.91 96.78 Favored 'General case' 0 C--N 1.355 0.833 0 CA-C-O 117.776 -1.107 . . . . 0.0 108.967 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -67.38 -38.44 84.73 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.458 -1.401 . . . . 0.0 111.285 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -54.57 38.25 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -56.39 -48.23 77.31 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.49 1.916 . . . . 0.0 109.783 178.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.19 -50.48 71.09 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 127.15 2.18 . . . . 0.0 110.134 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.0 t -50.84 -41.28 57.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.002 0.921 . . . . 0.0 111.253 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 6.8 mt -72.85 -41.66 64.55 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 120.504 -1.372 . . . . 0.0 110.596 -176.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.9 mt -59.56 -45.07 92.89 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 173.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -63.04 -50.78 69.29 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.008 2.123 . . . . 0.0 110.164 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.71 -44.03 77.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.192 1.797 . . . . 0.0 110.08 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -57.35 -46.89 82.86 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.777 -0.63 . . . . 0.0 109.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -55.36 -47.18 76.15 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.661 1.184 . . . . 0.0 110.457 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.44 -39.4 88.87 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -178.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -39.81 93.41 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 124.987 1.315 . . . . 0.0 111.256 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.6 mt -60.56 -55.2 36.19 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.136 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 23.1 mm -60.68 -41.26 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 121.068 1.758 . . . . 0.0 111.199 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -62.74 -15.59 53.9 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 119.985 -1.697 . . . . 0.0 113.134 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -98.43 13.79 30.42 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 129.263 3.025 . . . . 0.0 111.028 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -104.25 -61.78 1.4 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 120.502 1.501 . . . . 0.0 109.736 173.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -63.91 -7.75 9.15 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 79.2 p -113.01 -64.4 1.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.065 2.546 . . . . 0.0 109.05 -173.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -93.42 -64.51 1.08 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.102 2.161 . . . . 0.0 111.023 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 134.52 119.95 2.01 Favored Glycine 0 CA--C 1.529 0.961 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 7.1 mt -78.22 131.16 37.03 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.11 171.28 5.79 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.35 -43.89 96.4 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.794 -0.622 . . . . 0.0 110.594 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.49 -54.32 29.97 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -60.18 -30.53 69.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 O-C-N 119.534 -1.978 . . . . 0.0 115.658 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -68.44 -32.97 73.37 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.641 1.176 . . . . 0.0 109.971 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.42 -38.17 50.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 117.824 -1.084 . . . . 0.0 108.72 174.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.91 -44.22 50.1 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 119.857 1.208 . . . . 0.0 108.256 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.1 mp -57.79 -44.55 86.37 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.47 175.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -46.8 79.7 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.421 1.464 . . . . 0.0 108.542 177.594 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -30.33 70.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -39.86 70.87 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.494 1.518 . . . . 0.0 110.016 173.437 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -65.11 -38.91 92.23 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.636 1.574 . . . . 0.0 110.887 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -34.35 77.68 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.11 174.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -32.49 63.62 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 128.228 2.611 . . . . 0.0 111.497 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER -90.63 -24.19 20.59 Favored 'General case' 0 C--O 1.259 1.572 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 49.95 63.59 2.12 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 127.982 2.513 . . . . 0.0 111.905 175.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 3.7 mmtm 71.72 -174.61 0.17 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.869 2.068 . . . . 0.0 107.015 -173.114 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.8 tttm . . . . . 0 C--O 1.283 2.825 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -176.411 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.46 176.7 0.28 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 127.539 2.335 . . . . 0.0 109.342 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 60.0 m -113.51 -77.71 0.58 Allowed 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 13.6 t 41.45 44.79 2.57 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.269 1.828 . . . . 0.0 112.789 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 ptt? 52.62 3.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.629 2.772 . . . . 0.0 115.551 -173.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 65.6 mtt-85 -81.69 -48.06 12.17 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 116.363 -1.779 . . . . 0.0 110.881 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . 0.414 HG22 ' CD1' ' A' ' 457' ' ' LEU . 0.5 OUTLIER -57.64 -49.77 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.081 1.309 . . . . 0.0 109.514 -177.182 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.61 -41.97 64.16 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.661 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 96.7 mt -73.52 -53.49 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 119.498 1.044 . . . . 0.0 112.195 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.95 -29.08 72.53 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 119.74 1.155 . . . . 0.0 113.737 -173.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.414 ' CD1' HG22 ' A' ' 453' ' ' ILE . 40.5 mt -70.91 -43.12 68.95 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.571 1.186 . . . . 0.0 108.73 174.05 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.57 -35.19 77.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.488 1.515 . . . . 0.0 110.765 174.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.28 -47.05 95.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.29 -0.881 . . . . 0.0 110.245 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -83.09 -14.38 53.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.522 0.729 . . . . 0.0 110.822 -174.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 55.6 t-20 -145.09 78.6 12.33 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.511 1.924 . . . . 0.0 111.403 -179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.72 -20.01 64.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 121.019 1.146 . . . . 0.0 113.331 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.56 -15.95 59.45 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.137 1.335 . . . . 0.0 111.109 174.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 45.3 mt -63.4 -15.76 58.52 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 121.022 -1.048 . . . . 0.0 109.942 173.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.72 -25.22 68.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.932 0.787 . . . . 0.0 110.831 173.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 63.4 m -83.54 -17.4 41.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 0.999 . . . . 0.0 111.881 174.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.4 mt -94.34 -5.59 46.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 111.98 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 7.1 p -82.95 144.81 48.39 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 120.662 1.574 . . . . 0.0 108.691 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.66 164.38 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.586 2.857 . . . . 0.0 111.461 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -67.57 12.87 0.18 Allowed 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 124.232 3.288 . . . . 0.0 114.445 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.319 1.7 mp 80.67 8.34 1.27 Allowed 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 129.207 3.003 . . . . 0.0 115.664 173.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -33.33 -55.2 0.42 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.188 2.995 . . . . 0.0 115.01 -174.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.09 -5.53 21.99 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.757 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 45.6 mt -71.21 -86.29 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.561 1.544 . . . . 0.0 110.887 -178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . 0.276 24.2 t0 58.96 140.97 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.946 3.298 . . . . 0.0 111.696 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -65.64 -29.91 70.55 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.234 1.814 . . . . 0.0 110.285 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -63.59 -24.2 67.7 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.764 1.165 . . . . 0.0 112.431 174.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -92.43 -17.23 24.86 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 120.934 1.697 . . . . 0.0 112.077 176.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 7.1 mt -128.32 86.32 58.18 Favored Pre-proline 0 CA--C 1.515 -0.378 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.76 90.15 0.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.057 1.838 . . . . 0.0 110.058 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 134.17 -16.18 4.44 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.537 2.018 . . . . 0.0 113.156 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.6 tp -58.19 -24.43 59.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.326 2.063 . . . . 0.0 110.277 173.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.6 -41.49 12.84 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 118.689 0.677 . . . . 0.0 111.875 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -40.79 94.09 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.148 1.474 . . . . 0.0 111.363 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -65.07 -53.03 52.01 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.89 1.276 . . . . 0.0 109.776 173.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -41.56 99.49 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.524 0.73 . . . . 0.0 111.127 -173.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.79 -44.0 82.43 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.815 0.846 . . . . 0.0 109.542 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.4 mt -54.8 -51.46 65.73 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.966 0.506 . . . . 0.0 111.023 174.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 55.4 t -56.81 -47.65 82.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 125.097 1.359 . . . . 0.0 109.924 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -55.46 -45.08 76.92 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.473 1.509 . . . . 0.0 110.079 179.244 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.3 m -65.41 -40.19 93.07 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.791 1.636 . . . . 0.0 111.263 174.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.8 m -64.85 -44.27 90.3 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 120.022 1.283 . . . . 0.0 110.397 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.24 -20.67 59.88 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.097 1.359 . . . . 0.0 112.815 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 16.8 t -93.43 -37.42 11.97 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.381 1.872 . . . . 0.0 111.367 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -76.76 105.79 2.75 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.95 1.3 . . . . 0.0 110.065 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.64 115.05 4.2 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.792 1.661 . . . . 0.0 110.94 -173.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.54 36.92 47.75 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.38 155.47 11.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.006 0.922 . . . . 0.0 110.542 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 10.8 p -139.87 174.09 10.87 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.2 m -55.95 -50.04 71.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.644 0.777 . . . . 0.0 109.859 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.08 -43.57 47.95 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -174.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -66.34 -24.52 66.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.347 1.059 . . . . 0.0 110.585 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.47 -52.47 61.24 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 119.609 1.095 . . . . 0.0 109.035 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.83 -38.77 89.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 118.551 -0.738 . . . . 0.0 109.919 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.66 -40.98 98.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.404 0.682 . . . . 0.0 110.709 177.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.59 -20.49 63.64 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.152 -0.968 . . . . 0.0 112.713 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -106.61 14.36 27.09 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.392 1.077 . . . . 0.0 109.004 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -58.59 119.93 7.94 Favored 'General case' 0 CA--C 1.528 0.118 0 O-C-N 119.801 -1.812 . . . . 0.0 111.41 -174.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.9 15.98 66.35 Favored Glycine 0 CA--C 1.527 0.783 0 CA-C-O 119.176 -0.791 . . . . 0.0 113.012 177.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.43 HG23 ' H ' ' A' ' 512' ' ' ASN . 25.3 m -98.17 153.07 18.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -173.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -60.19 -20.35 58.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.225 -0.922 . . . . 0.0 112.039 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.43 ' H ' HG23 ' A' ' 510' ' ' THR . 76.5 m-20 -89.83 -19.31 24.81 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.128 1.771 . . . . 0.0 110.519 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.61 -51.13 58.09 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 124.473 1.109 . . . . 0.0 110.213 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.92 -44.18 60.08 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.942 0.897 . . . . 0.0 112.321 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 53.0 m -62.24 -50.41 71.84 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.884 174.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 21.9 mt -60.09 -39.15 85.12 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.555 1.07 . . . . 0.0 111.534 178.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.94 -45.79 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.807 2.043 . . . . 0.0 109.381 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -61.42 -29.86 70.2 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.335 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 73.8 mt -88.41 -6.37 57.71 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.782 1.233 . . . . 0.0 112.168 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.9 t -83.24 -50.29 8.56 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 126.46 1.904 . . . . 0.0 109.081 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.92 9.37 6.56 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.879 1.271 . . . . 0.0 113.1 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . 0.448 ' C ' ' H ' ' A' ' 524' ' ' ASP . 5.9 t90 -76.58 78.23 3.26 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.942 1.697 . . . . 0.0 113.448 -172.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.55 -0.78 0.07 Allowed 'General case' 0 CA--C 1.534 0.33 1 C-N-CA 131.797 4.039 . . . . 0.0 113.526 174.156 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . 0.448 ' H ' ' C ' ' A' ' 522' ' ' TRP . 10.7 t70 -54.7 -26.92 36.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.044 2.138 . . . . 0.0 111.49 174.586 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -112.73 -50.69 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 125.84 1.656 . . . . 0.0 110.72 175.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 42.97 47.19 4.9 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.571 1.948 . . . . 0.0 113.306 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.0 173.01 16.57 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 174.345 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -131.28 -19.96 2.74 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 127.19 2.196 . . . . 0.0 111.809 177.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.88 -56.13 3.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.211 2.204 . . . . 0.0 106.902 173.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 65.2 mt -59.06 -28.33 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.087 0.555 . . . . 0.0 109.75 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.11 -40.15 67.04 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.564 1.145 . . . . 0.0 111.937 176.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -49.97 65.78 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.362 0.983 . . . . 0.0 109.588 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -62.31 -46.57 88.13 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.768 0.427 . . . . 0.0 110.448 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.7 m -66.29 -30.64 71.11 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.604 1.161 . . . . 0.0 110.253 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -69.7 -46.14 66.66 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 119.632 1.106 . . . . 0.0 108.985 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 56.7 m -61.25 -41.08 96.28 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.273 0.488 . . . . 0.0 110.315 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.6 -47.46 86.1 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.997 0.919 . . . . 0.0 111.074 174.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 20.5 t -63.7 -44.9 92.28 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.156 -0.965 . . . . 0.0 111.963 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.02 -50.92 69.56 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.44 -0.79 . . . . 0.0 109.74 175.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -54.77 -44.52 73.77 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.12 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -66.7 -35.57 80.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 119.868 1.213 . . . . 0.0 111.044 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -49.12 71.28 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 174.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -64.18 -47.09 81.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.687 0.676 . . . . 0.0 111.303 -178.329 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.75 -49.05 69.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.419 2.687 . . . . 0.0 108.53 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 23.2 t -58.68 -42.66 89.02 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.708 -0.62 . . . . 0.0 111.48 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 60.2 mt -71.61 -32.33 67.89 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 119.165 0.893 . . . . 0.0 110.155 -175.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.7 mt -70.85 -41.05 71.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.618 0.767 . . . . 0.0 109.118 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.29 -50.58 71.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.002 0.921 . . . . 0.0 109.184 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 51.7 mt -57.83 -39.06 76.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.206 1.003 . . . . 0.0 110.448 174.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -61.84 -42.94 99.66 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 118.103 -0.951 . . . . 0.0 108.771 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.61 -41.34 97.33 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 116.108 -1.901 . . . . 0.0 110.368 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.37 -46.0 90.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.177 2.262 . . . . 0.0 109.811 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -63.17 -39.09 93.64 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -174.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.58 -51.46 42.33 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.956 1.302 . . . . 0.0 111.388 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.8 mm -64.16 -36.62 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 119.536 1.062 . . . . 0.0 109.123 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.45 -33.61 75.94 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.335 -1.478 . . . . 0.0 111.48 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 52.0 mtt-85 -61.14 -32.43 72.13 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 116.331 -1.795 . . . . 0.0 109.323 173.912 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -57.22 -42.29 81.08 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 121.402 1.91 . . . . 0.0 110.527 176.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.94 3.65 7.9 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -177.187 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -148.92 -85.89 0.09 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.417 1.008 . . . . 0.0 108.934 -179.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 3.2 m-70 -47.4 -41.32 19.71 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.994 2.118 . . . . 0.0 113.558 179.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.8 101.16 1.21 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.15 132.61 54.54 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 173.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 170.58 13.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 122.918 1.342 . . . . 0.0 109.249 176.225 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -40.02 94.86 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.804 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -46.63 60.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.706 1.879 . . . . 0.0 109.124 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -65.39 -35.27 80.44 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.517 1.053 . . . . 0.0 111.598 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 9.7 ttm180 -63.01 -31.75 72.96 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 120.595 -1.315 . . . . 0.0 109.472 174.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 5.0 mp -78.23 -32.3 49.71 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.458 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.49 -43.38 84.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.699 1.59 . . . . 0.0 107.671 173.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.4 mt -58.22 -39.84 80.08 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-O 116.481 -1.723 . . . . 0.0 113.269 175.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -62.38 -40.68 97.26 Favored 'General case' 0 C--N 1.345 0.413 0 CA-C-N 122.383 2.356 . . . . 0.0 109.095 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -41.63 76.55 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -40.21 87.6 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.595 -1.315 . . . . 0.0 110.77 174.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -57.93 -42.98 86.0 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.758 1.223 . . . . 0.0 110.331 174.031 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.43 -27.8 52.36 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.295 1.407 . . . . 0.0 111.375 -176.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.47 -42.29 83.22 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 22.8 mt -78.81 -23.8 44.91 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 118.7 0.682 . . . . 0.0 110.887 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -59.51 -29.85 68.16 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.744 -0.597 . . . . 0.0 111.948 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp 49.43 -71.95 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 129.771 3.228 . . . . 0.0 114.16 173.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt . . . . . 0 CA--C 1.533 0.322 0 O-C-N 119.965 -1.71 . . . . 0.0 106.754 173.813 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 9.3 tptt . . . . . 0 C--O 1.236 0.375 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.39 158.51 1.12 Allowed 'General case' 0 CA--C 1.505 -0.778 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -173.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 10.8 t -163.79 158.53 20.23 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 173.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -130.52 164.03 25.76 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.782 1.633 . . . . 0.0 107.372 -174.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -52.65 -19.02 2.07 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.7 mmm-85 -59.75 -39.68 85.58 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-O 118.179 -0.915 . . . . 0.0 109.61 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 mm -67.98 -43.83 85.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.147 0 CA-C-O 115.146 -2.359 . . . . 0.0 108.873 176.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -59.05 -54.51 46.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.47 1.941 . . . . 0.0 108.694 -177.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 25.6 mt -59.97 -59.63 3.74 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 124.266 1.026 . . . . 0.0 111.098 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.36 -29.32 71.17 Favored Glycine 0 N--CA 1.468 0.787 0 CA-C-N 120.847 1.658 . . . . 0.0 113.551 -173.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.422 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.1 OUTLIER -71.34 -45.89 61.87 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.457 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.44 -32.12 73.47 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 127.415 2.286 . . . . 0.0 110.83 175.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 18.6 t -66.67 -55.08 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 124.654 1.182 . . . . 0.0 108.201 174.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -72.2 -17.73 61.91 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 118.707 -0.663 . . . . 0.0 112.461 -179.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -146.29 80.62 10.01 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 127.164 2.186 . . . . 0.0 110.68 -174.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.6 -20.92 34.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.207 1.938 . . . . 0.0 112.296 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -66.92 -18.92 65.61 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.929 0.892 . . . . 0.0 110.039 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 43.9 mt -63.85 -12.09 33.27 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.953 1.706 . . . . 0.0 110.179 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.94 87.93 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 119.015 0.825 . . . . 0.0 109.818 173.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 61.3 m -69.21 -13.28 62.32 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.899 0.772 . . . . 0.0 111.967 174.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.71 -15.91 20.16 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.403 1.002 . . . . 0.0 112.573 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . 0.406 HG22 ' CZ ' ' A' ' 485' ' ' PHE . 0.3 OUTLIER -80.26 146.49 62.47 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.87 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -74.33 169.06 23.35 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.829 3.019 . . . . 0.0 112.072 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.83 0.51 5.59 Favored 'Trans proline' 0 CA--C 1.552 1.381 0 C-N-CA 122.703 2.269 . . . . 0.0 114.819 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.286 1.2 mp 76.04 39.92 0.28 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 130.063 3.345 . . . . 0.0 115.816 177.225 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.68 -51.55 48.33 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.299 1.44 . . . . 0.0 114.108 -178.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.72 2.49 19.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.004 -1.685 . . . . 0.0 111.732 174.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 5.8 mp -112.4 -74.29 0.64 Allowed 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 123.375 0.67 . . . . 0.0 111.083 -173.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 5.9 t70 60.06 169.24 0.08 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.928 1.823 . . . . 0.0 110.348 -173.078 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -84.23 -24.4 30.05 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 125.823 1.649 . . . . 0.0 108.886 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -56.12 -48.43 76.22 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 126.397 1.879 . . . . 0.0 108.609 173.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -74.81 -32.04 61.87 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 119.012 -1.075 . . . . 0.0 111.99 -174.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 17.0 mt -131.09 115.92 16.61 Favored Pre-proline 0 C--O 1.225 -0.214 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -173.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.25 -51.47 0.34 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 CA-C-N 120.67 1.275 . . . . 0.0 111.739 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -67.08 -19.9 70.44 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.862 1.22 . . . . 0.0 112.207 -177.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -61.15 -33.5 73.51 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.567 1.547 . . . . 0.0 110.418 174.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.35 -47.86 6.9 Favored Glycine 0 CA--C 1.527 0.814 0 O-C-N 123.833 0.708 . . . . 0.0 111.844 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -41.35 91.03 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.133 0.973 . . . . 0.0 112.315 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . 0.406 ' CZ ' HG22 ' A' ' 468' ' ' VAL . 41.2 t80 -66.81 -51.17 58.88 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.578 1.535 . . . . 0.0 109.777 174.328 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -55.63 -47.31 76.82 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 118.449 0.568 . . . . 0.0 111.0 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.48 -39.99 92.59 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.891 0.876 . . . . 0.0 110.792 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.4 mt -64.06 -47.6 79.53 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.85 1.26 . . . . 0.0 112.484 174.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 49.4 t -59.0 -49.45 83.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.465 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 174.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -55.33 -44.11 75.59 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.662 1.185 . . . . 0.0 108.944 -176.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 55.0 m -63.01 -43.86 97.59 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.671 2.389 . . . . 0.0 111.837 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.6 m -63.6 -44.06 95.11 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.251 0.932 . . . . 0.0 109.457 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -16.99 64.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.71 1.204 . . . . 0.0 111.229 173.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.68 -16.44 26.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.753 1.221 . . . . 0.0 112.293 176.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -122.26 82.45 45.48 Favored Pre-proline 0 CA--C 1.536 0.427 0 C-N-CA 124.848 1.259 . . . . 0.0 107.796 175.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -63.57 139.38 69.72 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 N-CA-C 108.114 -1.533 . . . . 0.0 108.114 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 78.69 15.45 80.76 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 118.394 -1.225 . . . . 0.0 113.996 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.05 166.4 4.73 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 120.079 1.939 . . . . 0.0 109.183 173.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.7 p -140.93 163.01 34.12 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 119.569 -1.957 . . . . 0.0 108.982 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.4 m -47.63 -41.72 22.68 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.333 1.453 . . . . 0.0 112.469 174.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -85.02 -50.38 4.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -58.0 -24.19 57.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.007 1.723 . . . . 0.0 112.119 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 59.1 tp -58.6 -48.29 81.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.657 1.117 . . . . 0.0 108.865 173.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.46 -29.39 68.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.847 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.93 -43.78 78.37 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.615 0.766 . . . . 0.0 109.991 174.385 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.26 -21.13 61.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.77 1.168 . . . . 0.0 112.868 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -111.53 11.84 21.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.908 0.883 . . . . 0.0 110.163 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.76 126.59 24.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 120.477 -1.39 . . . . 0.0 110.832 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.97 15.39 81.22 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 118.704 -1.053 . . . . 0.0 114.501 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 75.2 m -93.1 148.23 22.18 Favored 'General case' 0 C--O 1.246 0.893 0 CA-C-N 119.222 1.511 . . . . 0.0 108.083 -179.302 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -58.29 -25.34 61.7 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.172 -0.955 . . . . 0.0 111.134 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -89.61 -17.94 27.5 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.278 2.231 . . . . 0.0 112.183 179.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.87 -49.42 62.95 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.917 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.36 -43.79 54.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.338 0.972 . . . . 0.0 112.567 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 78.9 m -60.58 -51.33 69.88 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 76.4 mt -57.13 -44.57 83.45 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 125.541 1.536 . . . . 0.0 112.512 175.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.53 -39.62 88.7 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.641 1.976 . . . . 0.0 109.137 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -37.46 84.71 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 78.7 mt -82.72 -9.53 59.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.641 0.776 . . . . 0.0 112.315 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.8 t -76.24 -59.88 2.57 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 0.0 107.583 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.35 22.58 0.67 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.784 2.034 . . . . 0.0 112.777 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.5 t90 -73.03 114.71 11.49 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.17 7.95 43.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 128.413 2.685 . . . . 0.0 114.595 -173.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -70.89 -40.0 72.48 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.441 -1.412 . . . . 0.0 109.13 173.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.422 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.3 pt -108.38 -70.67 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 127.361 2.264 . . . . 0.0 110.73 -174.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.12 37.79 11.57 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.76 2.024 . . . . 0.0 114.798 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -129.36 -178.74 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.5 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -137.07 -24.68 1.1 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.151 2.18 . . . . 0.0 112.301 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -91.18 -54.79 3.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.007 2.123 . . . . 0.0 108.073 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -62.35 -22.02 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.54 -52.75 63.59 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.279 1.4 . . . . 0.0 111.46 174.166 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -62.34 -42.21 99.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.301 1.41 . . . . 0.0 110.68 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -53.32 51.91 Favored 'General case' 0 C--N 1.34 0.184 0 O-C-N 122.025 -0.422 . . . . 0.0 111.079 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 33.5 m -61.26 -33.77 74.08 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.236 -1.364 . . . . 0.0 110.664 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -64.23 -49.32 72.42 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 121.242 1.837 . . . . 0.0 109.786 177.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.3 m -62.41 -45.31 93.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.411 1.084 . . . . 0.0 111.159 178.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.87 -43.79 98.13 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.12 1.368 . . . . 0.0 110.694 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 6.0 t -67.56 -45.9 74.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 124.319 1.048 . . . . 0.0 112.616 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.0 tt -54.92 -51.74 65.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -55.52 -44.53 76.75 Favored 'General case' 0 C--O 1.205 -1.245 0 C-N-CA 124.754 1.221 . . . . 0.0 111.327 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -63.3 -38.88 92.9 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.051 0.841 . . . . 0.0 112.053 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.3 -51.42 68.96 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.889 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -58.1 -48.35 80.45 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.849 0.86 . . . . 0.0 111.406 179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -57.52 -41.44 80.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.721 2.009 . . . . 0.0 109.495 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.5 t -56.73 -36.58 69.89 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.711 -1.243 . . . . 0.0 112.455 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 14.1 mt -81.99 -35.59 28.78 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 124.747 1.219 . . . . 0.0 109.284 -176.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -40.81 91.61 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.218 1.407 . . . . 0.0 108.766 174.152 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -59.68 -55.68 31.31 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.718 1.607 . . . . 0.0 108.429 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 18.5 mt -52.61 -47.58 66.87 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.491 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -64.36 -44.07 92.57 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.86 1.209 . . . . 0.0 110.128 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.33 -49.29 67.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.154 0.982 . . . . 0.0 108.88 173.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.27 -40.68 86.18 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.176 0.444 . . . . 0.0 110.336 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -54.78 -48.28 72.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.917 1.287 . . . . 0.0 108.969 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 5.1 mt -61.86 -52.73 62.92 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.685 1.594 . . . . 0.0 110.066 179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.8 mm -63.69 -35.95 74.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 121.88 2.127 . . . . 0.0 111.239 177.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.88 73.19 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 120.964 -1.085 . . . . 0.0 109.81 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 15.5 mtm180 -92.39 -3.64 54.99 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 116.724 -1.608 . . . . 0.0 111.223 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.47 -60.87 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 122.718 2.508 . . . . 0.0 105.151 173.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -14.52 62.84 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -173.342 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 62.2 p -114.01 -61.42 1.75 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 120.81 1.641 . . . . 0.0 109.631 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -82.25 -35.79 27.8 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.068 1.347 . . . . 0.0 113.733 -175.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 77.42 80.47 0.66 Allowed Glycine 0 C--N 1.338 0.688 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 -173.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 167.1 1.54 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 173.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 8.4 t -70.19 157.89 36.81 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 120.29 -1.506 . . . . 0.0 108.949 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -38.36 75.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.27 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -63.31 -51.86 64.28 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.322 1.049 . . . . 0.0 111.094 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -53.75 -40.88 66.55 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.534 1.061 . . . . 0.0 111.361 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 4.5 tmt_? -60.93 -39.37 89.19 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.392 -1.443 . . . . 0.0 109.981 176.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 7.7 mp -72.79 -33.96 66.61 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 116.937 -1.506 . . . . 0.0 110.962 175.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.63 -43.74 62.7 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.446 1.475 . . . . 0.0 108.967 174.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.6 mt -57.06 -39.22 74.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -41.24 92.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 121.442 1.928 . . . . 0.0 108.157 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -35.48 80.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 122.442 0.297 . . . . 0.0 111.369 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.05 -41.35 70.9 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.578 -1.326 . . . . 0.0 109.99 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -60.24 -37.64 81.01 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.992 -1.067 . . . . 0.0 111.246 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -71.54 -32.81 68.56 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.594 1.088 . . . . 0.0 111.019 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -66.74 -40.69 88.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.08 0.952 . . . . 0.0 110.318 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 mt -83.51 -18.71 37.53 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.147 -0.97 . . . . 0.0 108.791 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -66.89 -29.91 69.93 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 119.944 -1.723 . . . . 0.0 113.345 174.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? 14.98 92.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.807 2.843 . . . . 0.0 114.642 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt . . . . . 0 N--CA 1.477 0.92 0 C-N-CA 126.424 1.89 . . . . 0.0 110.839 -178.589 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.162 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.49 154.74 47.77 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.333 -2.099 . . . . 0.0 105.333 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 93.5 m -62.76 151.7 37.88 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 124.136 0.974 . . . . 0.0 109.678 174.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 5.5 t -82.16 167.06 19.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.852 1.261 . . . . 0.0 110.086 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.37 47.02 0.99 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -120.53 -42.92 2.52 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.888 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 4.8 mm -68.94 -52.22 36.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.642 0 CA-C-O 117.6 -1.19 . . . . 0.0 108.788 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.1 mt -54.23 -50.17 67.76 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 120.405 1.457 . . . . 0.0 110.595 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 81.9 mt -64.58 -55.6 20.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.163 176.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.98 -44.1 92.88 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 120.045 1.293 . . . . 0.0 112.815 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.9 mt -65.26 -50.28 66.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.459 176.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.82 -34.42 74.51 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.963 0.801 . . . . 0.0 111.744 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.64 -48.85 84.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 120.899 -1.125 . . . . 0.0 109.679 175.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -79.12 -17.11 55.67 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.918 -0.489 . . . . 0.0 111.685 175.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -131.42 70.96 81.78 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-N 119.637 1.108 . . . . 0.0 109.198 -176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.85 -18.89 53.06 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.704 1.603 . . . . 0.0 111.576 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -67.45 -23.0 65.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.925 0.89 . . . . 0.0 110.605 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 63.2 mt -62.12 -12.51 19.89 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 120.867 -1.145 . . . . 0.0 110.356 173.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -59.7 -39.79 85.74 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.946 1.248 . . . . 0.0 111.673 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 53.6 m -77.17 -13.96 59.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 120.163 1.347 . . . . 0.0 111.993 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.3 mt -90.73 -19.27 23.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.356 1.063 . . . . 0.0 112.516 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -81.77 149.21 63.34 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 17.0 Cg_endo -69.36 173.99 9.81 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.142 3.228 . . . . 0.0 112.08 173.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -75.06 5.21 4.15 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 124.046 3.164 . . . . 0.0 114.048 175.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 7.1 mp 67.62 53.61 0.7 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.954 2.502 . . . . 0.0 111.675 177.288 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.51 -65.66 0.9 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.95 1.3 . . . . 0.0 108.95 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.3 -12.17 60.62 Favored 'General case' 0 C--N 1.344 0.369 0 O-C-N 120.969 -1.082 . . . . 0.0 111.775 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 22.4 mt -82.49 -77.14 0.24 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -178.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.2 t0 65.83 150.87 0.05 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.064 1.746 . . . . 0.0 111.999 -174.242 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.2 -10.01 59.14 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 120.325 -1.484 . . . . 0.0 111.313 178.258 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -82.09 -37.39 26.41 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.141 0.976 . . . . 0.0 111.102 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -85.23 -29.51 24.6 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 118.508 -0.758 . . . . 0.0 110.414 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -116.16 89.44 25.6 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.475 1.11 . . . . 0.0 109.138 -174.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.9 87.04 0.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.293 3.328 . . . . 0.0 110.146 -176.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 135.09 -15.57 4.25 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.767 1.651 . . . . 0.0 112.86 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -64.05 -25.95 68.34 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-O 116.968 -1.492 . . . . 0.0 110.962 173.827 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.99 -40.47 12.72 Favored Glycine 0 C--O 1.218 -0.866 0 CA-C-N 119.68 1.127 . . . . 0.0 111.39 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 35.2 tp -61.33 -43.02 99.58 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.82 1.31 . . . . 0.0 112.504 176.53 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -66.34 -47.59 73.0 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.35 1.06 . . . . 0.0 110.527 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 65.6 ttt-85 -58.73 -51.13 71.28 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.197 -178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -43.31 99.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 123.83 0.707 . . . . 0.0 110.297 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.82 -49.01 78.08 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 123.56 0.744 . . . . 0.0 111.609 179.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 71.9 t -62.35 -48.19 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.238 175.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -53.65 -45.76 70.33 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.907 1.683 . . . . 0.0 108.558 -176.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 3.0 m -66.47 -45.73 78.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.401 1.88 . . . . 0.0 110.359 173.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 87.5 m -57.88 -40.3 79.93 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 121.352 1.887 . . . . 0.0 112.065 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.7 -24.5 67.59 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.36 1.464 . . . . 0.0 111.774 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -49.72 12.85 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.363 0.665 . . . . 0.0 110.172 174.238 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -73.84 102.45 0.62 Allowed Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 124.291 1.036 . . . . 0.0 110.584 -173.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.41 124.35 11.95 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 109.626 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.73 41.98 99.76 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 123.853 0.74 . . . . 0.0 111.379 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 24.9 tp -61.13 156.17 18.84 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.528 0.68 . . . . 0.0 110.083 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.57 165.42 21.75 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.0 m -54.52 -43.25 71.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.448 1.499 . . . . 0.0 110.943 176.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -78.3 -39.14 23.63 Favored Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.42 -26.81 68.14 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.084 0.553 . . . . 0.0 111.849 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 38.2 tp -60.12 -52.68 64.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.11 -31.44 72.64 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 122.053 -0.404 . . . . 0.0 111.745 -179.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -44.12 79.14 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.321 1.048 . . . . 0.0 110.442 175.446 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -61.16 -17.31 52.3 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.833 -1.167 . . . . 0.0 112.714 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -113.73 16.29 18.57 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.785 2.034 . . . . 0.0 110.141 177.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -58.44 133.21 55.57 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 119.837 -1.789 . . . . 0.0 109.149 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 69.93 27.97 72.43 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.038 -0.413 . . . . 0.0 112.581 173.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 53.6 m -108.14 145.91 33.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -61.72 -12.04 14.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.794 1.237 . . . . 0.0 112.062 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 4.8 m120 -107.55 -14.13 14.91 Favored 'General case' 0 C--N 1.372 1.555 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 -174.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -48.82 -51.33 30.02 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 120.394 1.452 . . . . 0.0 110.021 172.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.42 -43.26 54.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.374 1.47 . . . . 0.0 113.534 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 17.5 m -64.86 -54.07 36.83 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 9.6 mt -56.1 -34.2 65.8 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 124.278 1.031 . . . . 0.0 111.684 -178.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.37 -39.95 92.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 126.417 1.887 . . . . 0.0 107.853 176.839 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -63.44 -29.74 70.97 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.126 1.33 . . . . 0.0 112.114 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -86.84 -41.82 13.74 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 125.954 1.702 . . . . 0.0 110.874 177.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 14.5 t -61.29 -49.84 75.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.508 1.123 . . . . 0.0 110.323 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -71.9 -7.59 49.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 126.198 1.799 . . . . 0.0 112.729 175.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -72.89 131.21 41.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.46 14.86 7.13 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.062 1.745 . . . . 0.0 109.506 -173.872 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -61.23 -24.99 66.76 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.042 1.737 . . . . 0.0 110.464 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -99.1 -59.45 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 128.564 2.746 . . . . 0.0 109.403 175.279 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.37 30.54 1.58 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.253 2.221 . . . . 0.0 112.656 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -140.41 165.52 27.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.672 1.189 . . . . 0.0 108.847 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -126.52 -30.42 2.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.628 2.371 . . . . 0.0 111.142 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -79.83 -57.03 3.85 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.737 1.615 . . . . 0.0 107.74 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 51.3 mt -59.72 -28.87 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.79 -58.85 6.55 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.869 -1.062 . . . . 0.0 109.426 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.54 -42.72 75.0 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 120.387 1.449 . . . . 0.0 110.777 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -63.6 -55.19 25.66 Favored 'General case' 0 C--O 1.22 -0.456 0 O-C-N 121.85 -0.532 . . . . 0.0 110.303 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 98.3 m -64.02 -26.9 68.77 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.258 1.423 . . . . 0.0 110.239 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -64.42 -59.08 4.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.582 1.083 . . . . 0.0 109.151 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 55.8 m -60.56 -44.92 95.63 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.771 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.05 -44.71 94.48 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.667 1.121 . . . . 0.0 110.777 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 25.7 t -66.16 -49.81 66.11 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.799 2.04 . . . . 0.0 110.556 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.31 -53.6 42.19 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 123.839 0.856 . . . . 0.0 110.76 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.323 1.2 m-20 -64.25 -30.92 71.95 Favored 'General case' 0 N--CA 1.418 -2.045 0 C-N-CA 118.236 -1.385 . . . . 0.0 110.436 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -70.64 -31.56 68.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.148 1.34 . . . . 0.0 110.717 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -55.69 9.53 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -56.39 -48.17 77.43 Favored 'General case' 0 C--N 1.347 0.463 0 C-N-CA 123.727 0.811 . . . . 0.0 109.568 -179.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.5 -46.22 90.92 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.269 2.228 . . . . 0.0 110.655 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 34.9 t -51.56 -45.54 63.1 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.03 -0.419 . . . . 0.0 110.132 174.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 12.0 mt -74.0 -38.95 63.94 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.173 -176.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -47.0 87.11 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.78 -50.54 71.94 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.328 1.451 . . . . 0.0 110.974 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.61 -46.88 87.94 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.296 1.038 . . . . 0.0 109.834 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -64.48 -45.84 85.63 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.518 1.127 . . . . 0.0 109.25 177.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.05 -53.31 52.13 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.538 1.135 . . . . 0.0 109.333 175.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -58.61 -43.91 89.78 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 117.445 -1.264 . . . . 0.0 110.097 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -50.14 74.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.723 1.209 . . . . 0.0 110.037 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 2.6 mt -58.37 -53.33 59.53 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.073 1.349 . . . . 0.0 108.527 179.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.7 mm -65.02 -39.65 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.344 1.058 . . . . 0.0 110.891 -178.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.01 -33.11 72.75 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.146 2.178 . . . . 0.0 108.258 176.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.36 -2.27 58.5 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 116.143 -1.884 . . . . 0.0 110.8 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -89.41 -44.81 9.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 122.757 2.526 . . . . 0.0 109.622 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -68.63 -3.34 11.54 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 120.603 -1.311 . . . . 0.0 114.099 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.425 ' CG2' ' H ' ' A' ' 561' ' ' HIS . 0.6 OUTLIER -138.65 -87.98 0.23 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 119.469 1.031 . . . . 0.0 109.071 -175.376 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.425 ' H ' ' CG2' ' A' ' 560' ' ' THR . 8.6 m-70 -55.77 -27.58 51.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.536 1.934 . . . . 0.0 113.385 -178.411 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 61.37 83.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 126.499 1.999 . . . . 0.0 109.575 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.53 160.63 0.16 Allowed 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.073 0.949 . . . . 0.0 109.942 173.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.68 163.14 11.95 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.252 -1.379 . . . . 0.0 111.028 -176.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -55.04 -42.23 72.38 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.171 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.95 -50.33 69.06 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 124.806 1.242 . . . . 0.0 110.922 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -56.89 -38.62 73.04 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.174 1.352 . . . . 0.0 111.842 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.73 -38.84 84.08 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.83 -1.169 . . . . 0.0 109.748 176.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.06 -37.25 85.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.999 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.43 -43.08 75.01 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 124.708 1.203 . . . . 0.0 107.765 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.5 mt -58.39 -41.12 84.16 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.575 1.15 . . . . 0.0 113.692 174.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -46.87 88.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -58.85 -44.51 91.03 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 124.675 1.235 . . . . 0.0 108.462 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -46.73 86.55 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.493 1.517 . . . . 0.0 113.131 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -62.1 -42.44 99.22 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.702 1.601 . . . . 0.0 110.204 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -72.43 -24.17 61.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 117.276 -1.345 . . . . 0.0 112.065 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.21 -37.07 61.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.711 1.205 . . . . 0.0 108.874 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 10.8 mt -80.47 -13.57 59.01 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.186 -1.571 . . . . 0.0 113.093 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 35.43 76.62 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 130.357 3.463 . . . . 0.0 111.186 175.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.86 93.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.15 1.38 . . . . 0.0 113.136 -178.113 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt . . . . . 0 N--CA 1.469 0.495 0 CA-C-O 122.746 1.26 . . . . 0.0 109.727 175.267 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.3 tttt . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 121.448 0.642 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.59 160.85 31.12 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 173.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 46.65 -144.99 0.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.069 1.347 . . . . 0.0 108.653 -174.204 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.71 117.74 8.85 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 120.902 1.683 . . . . 0.0 110.324 173.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.0 mtt -75.86 40.85 0.2 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.438 1.495 . . . . 0.0 110.443 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -128.74 -42.08 1.45 Allowed 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 126.988 2.115 . . . . 0.0 108.765 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.4 mm -56.85 -52.41 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.278 0 CA-C-N 119.607 1.094 . . . . 0.0 109.039 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 34.8 mt -53.6 -33.12 53.82 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 82.0 mt -79.43 -54.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 C-N-CA 124.069 0.948 . . . . 0.0 110.208 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.17 -36.97 93.19 Favored Glycine 0 CA--C 1.523 0.546 0 CA-C-N 119.635 1.107 . . . . 0.0 111.692 -174.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -48.42 71.7 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.661 174.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.48 -31.25 69.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.459 1.103 . . . . 0.0 111.451 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.3 t -64.78 -57.78 9.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.314 1.046 . . . . 0.0 108.852 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.35 -32.4 73.99 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.226 -178.09 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -131.48 87.4 46.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 126.069 1.747 . . . . 0.0 109.652 -174.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.33 -17.99 39.24 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.504 1.469 . . . . 0.0 113.23 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -61.28 -22.51 64.92 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.064 1.302 . . . . 0.0 110.731 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 76.9 mt -57.05 -19.14 17.31 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.106 0.962 . . . . 0.0 112.205 174.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.1 -26.04 68.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.737 0.699 . . . . 0.0 112.462 174.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 85.6 m -83.9 -19.85 34.04 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.816 0.847 . . . . 0.0 111.069 174.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 9.6 mt -87.45 -14.75 39.62 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.452 0.701 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 14.9 p -82.68 140.93 44.25 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.795 1.179 . . . . 0.0 109.749 -178.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.81 164.91 17.45 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.421 2.747 . . . . 0.0 110.817 173.636 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -65.93 8.95 0.24 Allowed 'Trans proline' 0 CA--C 1.549 1.265 0 C-N-CA 124.871 3.714 . . . . 0.0 115.866 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER 90.49 -0.13 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 132.256 4.222 . . . . 0.0 113.535 175.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -34.52 -58.23 0.49 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.611 2.364 . . . . 0.0 115.724 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -98.07 2.76 49.07 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 80.8 mt -85.11 -65.66 0.98 Allowed 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.943 178.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 24.5 t0 57.88 118.8 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.446 1.898 . . . . 0.0 111.172 -173.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.92 -27.33 65.16 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.296 -1.502 . . . . 0.0 111.285 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -68.93 -23.58 64.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 117.548 -1.215 . . . . 0.0 112.206 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -84.93 -20.02 31.3 Favored 'General case' 0 C--N 1.348 0.529 0 CA-C-N 121.337 1.88 . . . . 0.0 111.393 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 1.2 mt -128.98 91.85 41.46 Favored Pre-proline 0 C--O 1.235 0.318 0 CA-C-N 119.364 0.984 . . . . 0.0 111.309 -173.235 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.16 85.23 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 124.114 3.209 . . . . 0.0 111.618 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.03 -22.33 2.45 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 125.505 1.526 . . . . 0.0 112.066 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.74 -32.09 68.91 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.963 1.382 . . . . 0.0 110.524 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -53.05 -32.55 42.7 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.301 0.955 . . . . 0.0 113.836 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.25 -44.35 95.42 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 119.584 1.692 . . . . 0.0 110.763 173.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -66.02 -39.6 90.36 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.671 0.789 . . . . 0.0 110.333 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.48 76.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 118.499 0.59 . . . . 0.0 110.255 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.94 -56.56 18.26 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.821 1.648 . . . . 0.0 108.186 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.57 -52.85 53.07 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.212 1.405 . . . . 0.0 111.964 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.41 -42.49 84.29 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 CA-C-N 119.684 1.129 . . . . 0.0 109.931 178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.58 -47.95 80.72 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.989 0.813 . . . . 0.0 109.818 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 94.2 m -63.0 -40.45 97.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.732 2.013 . . . . 0.0 110.51 176.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.5 m -64.64 -39.64 94.05 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 120.927 -1.108 . . . . 0.0 110.448 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.76 -16.86 64.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.966 0.906 . . . . 0.0 112.19 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.6 -41.16 12.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.739 1.615 . . . . 0.0 112.194 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -79.33 109.62 12.1 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 120.145 1.339 . . . . 0.0 110.1 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.75 108.96 2.68 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 121.217 1.278 . . . . 0.0 109.661 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.85 54.97 5.57 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.09 0.853 . . . . 0.0 111.705 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.1 165.76 8.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.411 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.93 168.31 20.06 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 176.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.4 m -49.24 -51.68 31.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.242 1.417 . . . . 0.0 110.152 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -79.37 -37.12 25.08 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -174.615 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.47 -31.43 72.58 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.253 0.621 . . . . 0.0 109.995 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 62.6 tp -60.48 -51.97 67.2 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 124.096 0.958 . . . . 0.0 110.349 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.44 -36.08 75.25 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 118.965 -0.54 . . . . 0.0 109.841 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.13 -38.95 75.69 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.318 0.508 . . . . 0.0 110.653 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -69.8 -21.22 63.42 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.663 0.665 . . . . 0.0 112.121 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -105.89 8.65 32.72 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.169 -1.582 . . . . 0.0 109.015 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -54.45 120.66 6.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 119.542 -1.974 . . . . 0.0 111.409 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 88.89 10.2 67.08 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.207 -0.774 . . . . 0.0 113.376 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.466 HG23 ' H ' ' A' ' 512' ' ' ASN . 25.0 m -92.26 152.49 19.79 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.941 1.371 . . . . 0.0 108.028 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.17 -16.25 42.57 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 121.259 -0.901 . . . . 0.0 112.448 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.466 ' H ' HG23 ' A' ' 510' ' ' THR . 61.7 t30 -93.93 -15.12 25.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.133 0.973 . . . . 0.0 111.103 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -53.75 -49.31 68.45 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.079 0.854 . . . . 0.0 110.461 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.89 58.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.739 0.699 . . . . 0.0 112.581 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 90.7 m -66.29 -44.79 82.51 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.894 -0.504 . . . . 0.0 110.285 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.22 -37.59 88.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.425 0.69 . . . . 0.0 111.011 178.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -62.08 -49.34 76.34 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.695 1.998 . . . . 0.0 108.531 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -55.06 -42.04 72.22 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.57 0.748 . . . . 0.0 110.952 174.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 87.7 mt -79.24 -13.56 59.6 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.476 0.71 . . . . 0.0 112.332 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 5.5 t -75.5 -51.64 12.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.19 0.996 . . . . 0.0 108.814 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 1.3 ptm -87.45 33.26 0.69 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 127.14 2.176 . . . . 0.0 111.135 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -88.02 94.92 9.94 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.394 1.092 . . . . 0.0 113.269 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -62.71 -7.8 5.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 128.175 2.59 . . . . 0.0 113.364 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.08 -13.96 62.15 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.564 1.945 . . . . 0.0 112.153 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 2.5 pt -137.87 -60.36 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.234 1.814 . . . . 0.0 110.304 -176.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 53.85 0.86 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.92 3.288 . . . . 0.0 117.822 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . 0.557 ' CG ' ' H ' ' A' ' 528' ' ' LYS . 28.6 t70 -108.47 -173.84 2.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.759 1.163 . . . . 0.0 112.795 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . 0.557 ' H ' ' CG ' ' A' ' 527' ' ' ASP . 0.0 OUTLIER -142.98 -25.84 0.6 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.284 2.634 . . . . 0.0 111.153 -174.017 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -82.67 -58.69 2.79 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 56.7 mt -55.87 -33.25 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.553 1.141 . . . . 0.0 108.463 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.99 -50.01 67.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.547 1.139 . . . . 0.0 112.531 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.56 -39.29 94.01 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.717 0.77 . . . . 0.0 110.17 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -68.59 -47.1 67.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.701 -0.624 . . . . 0.0 110.245 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 77.5 m -67.24 -27.27 67.08 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 112.154 175.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 82.6 t80 -65.03 -53.38 46.82 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 173.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 26.0 m -55.8 -44.54 77.9 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 124.44 1.096 . . . . 0.0 109.995 177.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.25 -45.88 82.78 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.9 t -64.89 -44.6 89.11 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.579 -0.7 . . . . 0.0 109.666 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 5.6 tt -56.51 -51.32 68.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.593 1.157 . . . . 0.0 109.776 174.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -61.6 -44.99 95.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.841 -178.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.43 -29.71 70.75 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.482 1.913 . . . . 0.0 109.872 175.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.01 -59.91 3.63 Favored 'General case' 0 C--N 1.342 0.243 0 O-C-N 120.735 -1.228 . . . . 0.0 107.787 173.199 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -59.35 -47.94 83.51 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 124.596 1.159 . . . . 0.0 110.527 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -50.16 -53.95 24.2 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 128.39 2.676 . . . . 0.0 109.479 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 16.7 t -67.3 -36.48 81.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.931 0.332 . . . . 0.0 111.588 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 18.7 mt -65.93 -35.92 81.93 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 119.961 -1.712 . . . . 0.0 110.022 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 32.0 mt -71.65 -38.36 70.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.188 1.395 . . . . 0.0 110.003 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.57 -53.98 51.83 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 108.492 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 65.7 mt -56.73 -46.76 81.14 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.837 1.255 . . . . 0.0 110.223 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -63.72 -36.89 85.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 118.398 -0.81 . . . . 0.0 111.032 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.22 -52.88 63.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.03 -39.06 91.01 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.706 0.685 . . . . 0.0 109.998 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.04 -45.87 91.68 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.5 1.12 . . . . 0.0 111.014 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.321 0.4 OUTLIER -76.24 -34.25 59.2 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.222 -0.924 . . . . 0.0 110.648 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.5 mm -66.52 -34.53 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 119.612 1.096 . . . . 0.0 109.241 173.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.33 82.83 Favored 'General case' 0 CA--C 1.522 -0.102 0 O-C-N 120.424 -1.423 . . . . 0.0 109.892 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -68.64 -5.53 20.69 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.12 176.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 -50.51 11.13 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 121.206 1.821 . . . . 0.0 109.69 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -77.25 14.68 0.87 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.915 1.286 . . . . 0.0 113.916 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -143.28 -81.78 0.19 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.454 -0.779 . . . . 0.0 109.04 176.095 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.445 ' H ' HG22 ' A' ' 560' ' ' THR . 2.3 m170 -61.53 -40.88 96.26 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.079 1.351 . . . . 0.0 112.615 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 95.96 126.64 5.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.979 1.276 . . . . 0.0 111.735 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -73.64 166.01 24.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 173.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 16.3 m -103.53 166.53 10.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.61 -36.24 69.2 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.495 -173.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -76.46 -53.3 8.31 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.32 1.013 . . . . 0.0 109.348 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.43 -26.91 68.95 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.361 0.982 . . . . 0.0 113.199 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.85 -26.33 61.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.384 -1.447 . . . . 0.0 110.274 175.107 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.2 -27.16 28.21 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.721 1.608 . . . . 0.0 110.373 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -52.05 -41.58 62.42 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 173.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.2 mt -61.04 -37.53 82.93 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.028 -1.463 . . . . 0.0 113.806 177.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -49.68 76.89 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 121.014 1.734 . . . . 0.0 107.916 174.388 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.4 m -65.24 -44.99 86.42 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.615 0.572 . . . . 0.0 110.25 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -43.87 80.3 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.459 1.104 . . . . 0.0 110.65 175.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.91 -34.24 77.01 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 121.523 -0.736 . . . . 0.0 110.893 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.38 -37.87 77.76 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.986 0.812 . . . . 0.0 110.392 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -68.3 -32.03 71.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.263 0.483 . . . . 0.0 110.118 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.8 mt -79.65 -29.95 41.08 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.121 -0.987 . . . . 0.0 110.205 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -61.31 -9.27 4.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.542 1.137 . . . . 0.0 113.792 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 120.34 6.64 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 120.225 1.375 . . . . 0.0 108.116 173.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 116.331 -1.795 . . . . 0.0 107.966 -173.384 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 69.89 174.02 0.3 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.626 1.57 . . . . 0.0 111.253 -176.398 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -101.4 107.34 18.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 125.269 1.427 . . . . 0.0 107.919 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 5.2 t -84.17 55.4 3.31 Favored 'General case' 0 N--CA 1.445 -0.687 0 O-C-N 121.494 -0.754 . . . . 0.0 110.18 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 4.5 tmm? 48.57 45.93 21.12 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 123.386 1.565 . . . . 0.0 110.903 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -127.9 -48.55 1.36 Allowed 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 116.928 -1.511 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.6 mm -61.15 -40.35 85.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.791 174.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.8 mt -62.31 -52.99 61.47 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 120.294 1.406 . . . . 0.0 109.907 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 73.5 mt -70.33 -55.33 14.91 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 117.787 -1.102 . . . . 0.0 110.86 -177.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -49.22 -55.71 11.93 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.452 ' CD2' ' N ' ' A' ' 457' ' ' LEU . 0.7 OUTLIER -50.97 -46.68 61.34 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 117.175 -1.393 . . . . 0.0 113.412 174.846 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . 0.601 ' CD1' ' HG ' ' A' ' 492' ' ' CYS . 2.3 tm? -61.95 -29.97 70.6 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 124.306 1.004 . . . . 0.0 111.345 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 22.2 t -67.81 -54.77 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 124.446 1.099 . . . . 0.0 109.126 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -74.6 -11.47 60.21 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.778 -0.576 . . . . 0.0 112.068 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -142.33 78.05 17.04 Favored Pre-proline 0 N--CA 1.445 -0.71 0 CA-C-N 118.513 0.597 . . . . 0.0 110.297 -178.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -65.57 -20.15 60.27 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 121.518 1.479 . . . . 0.0 111.206 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.55 -25.54 64.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.973 1.309 . . . . 0.0 111.509 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 25.9 mt -61.81 -15.09 38.9 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-N 119.285 0.948 . . . . 0.0 110.155 173.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -61.65 -40.44 94.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.219 -0.925 . . . . 0.0 110.039 173.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 83.4 m -72.88 -17.93 61.47 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.882 -1.136 . . . . 0.0 111.348 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 3.5 mt -84.99 -27.68 26.29 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.267 1.027 . . . . 0.0 109.665 175.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -60.8 144.98 89.19 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.635 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -69.86 168.55 21.37 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.165 1.91 . . . . 0.0 111.012 175.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -71.17 1.12 5.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.878 3.052 . . . . 0.0 114.004 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.2 mp 72.95 58.76 0.11 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 129.396 3.079 . . . . 0.0 109.338 174.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.02 -37.08 29.74 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.322 -0.861 . . . . 0.0 110.938 -173.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.1 17.42 21.66 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 125.295 1.438 . . . . 0.0 112.291 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.44 ' HG ' ' CZ ' ' A' ' 543' ' ' PHE . 15.2 mt -106.41 -94.9 0.36 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.232 -1.366 . . . . 0.0 109.004 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 46.6 t0 78.92 142.99 0.08 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.376 2.271 . . . . 0.0 109.83 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.93 -19.37 62.59 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.135 -0.978 . . . . 0.0 109.805 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -59.92 -43.17 95.08 Favored 'General case' 0 C--N 1.341 0.212 0 O-C-N 121.078 -1.013 . . . . 0.0 110.07 174.325 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -32.58 43.97 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 118.878 -0.582 . . . . 0.0 110.42 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 60.4 mt -131.9 96.2 20.85 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 125.839 1.655 . . . . 0.0 108.821 -174.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.28 1.95 3.68 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 123.428 2.752 . . . . 0.0 113.165 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -109.36 -13.53 16.95 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 120.99 -1.069 . . . . 0.0 111.838 174.044 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 5.6 tt -61.06 -35.43 76.92 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 116.687 -1.625 . . . . 0.0 108.816 174.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -41.95 -46.56 5.09 Favored Glycine 0 N--CA 1.479 1.536 0 CA-C-N 119.746 1.157 . . . . 0.0 111.553 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.66 -49.12 78.8 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.581 0.752 . . . . 0.0 110.709 177.756 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -59.8 -46.11 90.24 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.243 1.017 . . . . 0.0 111.274 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -49.69 76.05 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 117.611 -1.185 . . . . 0.0 107.994 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.64 -39.65 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.996 0.918 . . . . 0.0 110.601 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.13 -54.1 50.8 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.833 1.253 . . . . 0.0 111.329 174.461 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 88.8 t -60.04 -46.1 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 116.773 -1.584 . . . . 0.0 108.288 175.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -54.9 -50.06 69.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.377 1.871 . . . . 0.0 109.028 -175.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.6 m -58.0 -50.65 72.68 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.74 173.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . 0.601 ' HG ' ' CD1' ' A' ' 458' ' ' LEU . 90.1 m -61.2 -36.86 81.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.685 1.584 . . . . 0.0 112.75 -178.303 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -21.41 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 128.562 2.745 . . . . 0.0 110.974 173.832 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.32 -58.79 1.98 Allowed 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 117.658 -1.163 . . . . 0.0 108.669 173.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 97.2 mm-40 -46.24 93.06 0.05 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 128.345 2.658 . . . . 0.0 112.148 -173.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -73.16 119.84 6.25 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.653 2.235 . . . . 0.0 110.643 -173.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 66.32 36.99 92.44 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 14.3 tp -61.7 160.94 10.76 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-O 121.216 0.531 . . . . 0.0 110.139 175.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.97 165.83 24.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 90.3 m -53.68 -41.64 67.1 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.381 1.473 . . . . 0.0 109.825 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.06 -40.81 11.01 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -62.74 -29.43 70.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.052 0.541 . . . . 0.0 111.552 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.09 -53.73 53.39 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.86 -37.3 71.11 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.38 0.536 . . . . 0.0 111.578 176.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.04 -40.53 87.18 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.163 -0.336 . . . . 0.0 111.085 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -66.72 -15.71 63.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.777 1.231 . . . . 0.0 111.917 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -116.87 16.23 15.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.906 1.682 . . . . 0.0 109.158 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -56.98 131.8 50.9 Favored 'General case' 0 C--N 1.34 0.172 0 O-C-N 120.465 -1.397 . . . . 0.0 108.936 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.62 74.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-O 119.683 -0.51 . . . . 0.0 112.456 173.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 32.2 m -110.41 147.68 33.52 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.602 1.161 . . . . 0.0 108.485 179.265 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -61.09 -22.1 64.3 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 111.424 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -92.26 -16.95 25.46 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 124.884 1.274 . . . . 0.0 109.775 179.695 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.55 68.03 Favored 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.58 -45.83 63.26 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.899 0.88 . . . . 0.0 112.589 178.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 52.9 m -66.27 -43.99 84.87 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.866 -0.521 . . . . 0.0 109.843 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 50.3 mt -61.73 -38.39 87.77 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.818 1.247 . . . . 0.0 111.808 176.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -71.07 -41.02 71.25 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 127.314 2.246 . . . . 0.0 109.399 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -61.38 -38.44 87.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 86.7 mt -78.55 -11.53 59.97 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.694 -0.669 . . . . 0.0 112.634 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 22.7 t -79.75 -55.69 4.82 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 119.186 0.903 . . . . 0.0 108.769 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -74.01 5.99 3.79 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.279 1.431 . . . . 0.0 113.256 176.049 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -61.56 126.35 27.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.628 -0.67 . . . . 0.0 110.362 -173.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -110.82 6.22 21.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.908 2.083 . . . . 0.0 109.823 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.59 -30.57 70.88 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.558 -1.339 . . . . 0.0 109.958 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.424 ' CD1' HD22 ' A' ' 457' ' ' LEU . 1.1 pt -113.31 -77.91 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 129.148 2.979 . . . . 0.0 110.824 -174.569 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.7 57.75 5.65 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.286 1.434 . . . . 0.0 111.295 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -145.84 179.47 7.43 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.519 -0.738 . . . . 0.0 110.183 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -128.48 -37.88 1.78 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.444 2.297 . . . . 0.0 110.545 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -79.32 -59.74 2.64 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.096 1.758 . . . . 0.0 108.962 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 32.1 mt -60.23 -24.77 31.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-O 117.852 -1.071 . . . . 0.0 108.253 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.6 -66.75 0.34 Allowed 'General case' 0 C--N 1.347 0.473 0 C-N-CA 125.012 1.325 . . . . 0.0 110.199 176.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -45.83 63.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.184 0.594 . . . . 0.0 110.274 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -62.65 -50.88 69.47 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.573 -176.631 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 9.7 m -61.01 -34.43 74.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 126.331 1.852 . . . . 0.0 110.867 176.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -63.1 -57.23 11.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.204 0.911 . . . . 0.0 109.593 178.049 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 43.8 m -60.0 -42.2 93.75 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.982 -1.009 . . . . 0.0 109.4 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -54.85 -47.11 74.58 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.483 1.513 . . . . 0.0 110.354 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.3 t -62.67 -56.19 19.98 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.851 1.66 . . . . 0.0 109.901 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -48.63 -57.26 6.5 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.805 177.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -54.76 -44.24 73.45 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 126.826 2.05 . . . . 0.0 109.801 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -60.75 -44.04 97.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.473 1.109 . . . . 0.0 111.621 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -56.97 11.65 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.44 ' CZ ' ' HG ' ' A' ' 474' ' ' LEU . 27.1 m-85 -56.64 -48.51 77.37 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.417 0.448 . . . . 0.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -51.28 -53.98 30.45 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.328 1.851 . . . . 0.0 110.734 175.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 43.8 t -53.92 -44.42 70.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.95 -43.36 83.35 Favored 'General case' 0 C--O 1.225 -0.215 0 O-C-N 120.72 -1.238 . . . . 0.0 109.275 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.09 -48.52 78.4 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.405 1.482 . . . . 0.0 109.572 174.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.04 -54.4 42.0 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.425 1.09 . . . . 0.0 110.214 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 20.2 mt -54.7 -38.33 66.91 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 123.63 0.772 . . . . 0.0 109.558 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -65.37 -52.94 50.24 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -53.8 -51.05 64.73 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.517 1.127 . . . . 0.0 108.054 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.87 -41.1 99.26 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.027 -176.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -52.81 62.55 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 127.141 2.177 . . . . 0.0 109.863 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -51.3 70.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.852 1.261 . . . . 0.0 108.835 -179.134 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.88 -37.31 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.729 -1.232 . . . . 0.0 110.217 175.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.25 -10.13 56.35 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 126.268 1.827 . . . . 0.0 111.057 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -96.75 9.45 41.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 116.704 -1.617 . . . . 0.0 109.642 173.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -100.57 -46.67 5.12 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.53 1.968 . . . . 0.0 111.198 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.13 -16.28 63.94 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.883 -1.136 . . . . 0.0 112.595 179.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 1.5 t -113.38 -105.33 0.39 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -44.15 -56.03 4.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 128.234 2.614 . . . . 0.0 113.159 -173.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 116.98 133.05 4.98 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 128.318 2.866 . . . . 0.0 108.303 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.2 mt -78.41 -171.27 2.36 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.9 m -137.19 171.83 13.9 Favored 'General case' 0 CA--C 1.498 -1.022 0 O-C-N 119.458 -2.026 . . . . 0.0 110.324 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.24 -48.18 74.31 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 113.248 -1.796 . . . . 0.0 109.05 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -72.91 -48.89 33.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.371 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -56.16 -43.34 78.26 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.147 0.579 . . . . 0.0 110.293 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -60.76 -37.57 82.3 Favored 'General case' 0 C--N 1.346 0.425 0 O-C-N 121.14 -0.975 . . . . 0.0 111.251 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.99 -33.46 61.84 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 122.836 0.455 . . . . 0.0 109.916 176.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -60.91 -40.71 94.2 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 120.443 -1.41 . . . . 0.0 107.586 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.7 mt -59.84 -41.98 92.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 116.654 -1.641 . . . . 0.0 110.475 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -51.41 67.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.261 1.846 . . . . 0.0 106.974 177.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -59.55 -38.17 80.36 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 125.554 1.784 . . . . 0.0 109.123 -173.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.18 -52.69 57.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.396 1.478 . . . . 0.0 111.46 176.074 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -61.03 -45.75 93.51 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.54 1.936 . . . . 0.0 110.804 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -67.43 -26.37 66.38 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 118.143 -0.932 . . . . 0.0 110.365 -179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -32.38 73.84 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.569 1.148 . . . . 0.0 110.559 173.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 6.4 mt -83.55 -29.85 27.53 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 179.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -67.45 -51.42 51.71 Favored 'General case' 0 C--N 1.365 1.249 0 CA-C-O 121.994 0.902 . . . . 0.0 110.623 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 37.42 86.41 0.01 OUTLIER 'General case' 0 C--N 1.345 0.406 0 C-N-CA 130.569 3.547 . . . . 0.0 110.381 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.4 mttt . . . . . 0 N--CA 1.47 0.539 0 O-C-N 120.158 -1.589 . . . . 0.0 110.183 -173.141 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.721 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -55.96 -79.16 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.6 t -159.97 165.16 32.55 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 105.807 -1.924 . . . . 0.0 105.807 173.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 11.7 m -138.54 159.37 42.25 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.6 ptt? -53.04 -26.66 16.52 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 120.06 1.3 . . . . 0.0 112.842 174.746 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -61.29 -31.95 71.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.39 -2.243 . . . . 0.0 111.662 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 13.1 mm -63.23 -52.41 58.99 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 121.124 1.783 . . . . 0.0 108.791 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 10.7 mt -53.13 -50.38 64.62 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.522 1.055 . . . . 0.0 110.432 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 25.4 mt -59.0 -59.71 3.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.329 176.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.82 99.45 Favored Glycine 0 C--O 1.223 -0.535 0 CA-C-N 119.939 1.245 . . . . 0.0 112.54 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.457 ' CD2' HD13 ' A' ' 525' ' ' ILE . 1.0 OUTLIER -61.48 -43.51 98.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.565 -0.962 . . . . 0.0 108.619 177.095 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -65.79 -35.75 81.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.947 1.299 . . . . 0.0 111.373 175.1 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 75.2 t -59.9 -56.3 18.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 O-C-N 120.994 -1.066 . . . . 0.0 108.3 174.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -75.39 -9.92 58.99 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.981 -0.45 . . . . 0.0 111.944 -177.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.14 73.25 12.08 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 125.125 1.37 . . . . 0.0 109.894 -177.61 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.74 -19.99 59.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.782 2.321 . . . . 0.0 112.668 -174.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.29 -21.82 64.29 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.978 1.711 . . . . 0.0 110.153 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.45 HD12 ' CG ' ' A' ' 535' ' ' PHE . 76.5 mt -63.82 -13.51 45.1 Favored 'General case' 0 C--N 1.351 0.644 0 O-C-N 120.441 -1.412 . . . . 0.0 110.513 173.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.38 -32.64 74.37 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.122 0.874 . . . . 0.0 110.243 173.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.1 m -77.75 -17.35 57.64 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.783 -1.198 . . . . 0.0 110.943 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.79 -11.92 38.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 117.605 -1.188 . . . . 0.0 112.244 174.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 2.4 p -94.5 151.28 39.18 Favored Pre-proline 0 CA--C 1.542 0.671 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 179.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -72.77 177.72 7.26 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.42 2.747 . . . . 0.0 112.519 175.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.9 5.22 3.58 Favored 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.421 2.747 . . . . 0.0 114.643 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.254 1.8 mm? 71.18 47.81 0.39 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 129.342 3.057 . . . . 0.0 114.291 179.525 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -87.95 -20.09 26.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -173.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -106.05 -3.08 22.0 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.448 -1.407 . . . . 0.0 111.895 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 3.5 mp -109.1 -78.53 0.59 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 125.511 1.525 . . . . 0.0 108.508 -173.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 11.0 t70 62.61 162.73 0.09 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.121 1.768 . . . . 0.0 110.987 -173.274 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.8 -21.79 60.93 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.429 -1.419 . . . . 0.0 108.755 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -51.74 -43.29 62.84 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.159 2.584 . . . . 0.0 110.032 173.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -84.09 -49.7 8.65 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.477 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 13.0 mt -114.28 102.22 54.67 Favored Pre-proline 0 N--CA 1.47 0.556 0 C-N-CA 123.588 0.755 . . . . 0.0 112.034 -173.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.21 -26.03 15.18 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.56 2.174 . . . . 0.0 111.422 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -85.91 -15.98 64.19 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.646 -1.086 . . . . 0.0 112.656 174.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -25.55 65.22 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 119.021 1.41 . . . . 0.0 108.806 173.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.66 -48.35 7.38 Favored Glycine 0 C--O 1.218 -0.895 0 CA-C-N 119.85 1.205 . . . . 0.0 111.146 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -46.81 87.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.154 0.977 . . . . 0.0 110.677 176.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -59.74 -49.37 78.01 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.596 -0.69 . . . . 0.0 110.846 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -64.66 -44.85 89.1 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 124.881 1.272 . . . . 0.0 110.028 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.37 -49.45 76.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.753 1.221 . . . . 0.0 108.131 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.15 -51.33 70.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.342 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 38.6 t -56.69 -46.79 83.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 124.656 1.182 . . . . 0.0 109.935 176.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -58.32 -46.76 85.57 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.019 1.327 . . . . 0.0 108.587 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 18.1 m -64.53 -39.68 94.21 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 124.188 0.995 . . . . 0.0 110.364 173.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 81.1 m -62.99 -41.96 99.71 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 120.777 1.626 . . . . 0.0 110.775 179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.57 -22.84 67.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.667 1.587 . . . . 0.0 111.355 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.1 t -85.25 -50.44 7.36 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.752 0.821 . . . . 0.0 110.206 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -67.6 104.44 0.66 Allowed Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.3 1.84 . . . . 0.0 110.424 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -68.09 122.55 9.64 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.097 1.865 . . . . 0.0 110.018 -174.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.12 40.4 99.14 Favored Glycine 0 C--N 1.34 0.764 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 34.8 tp -57.35 155.64 8.82 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.255 1.026 . . . . 0.0 110.662 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' THR . . . . . 0.438 ' HG1' ' CB ' ' A' ' 502' ' ' GLN . 2.4 p -143.0 163.36 32.99 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 37.4 m -50.41 -48.58 56.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.653 1.981 . . . . 0.0 110.431 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.6 17.36 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.438 ' CB ' ' HG1' ' A' ' 499' ' ' THR . 50.8 tp60 -59.89 -24.41 64.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.757 1.223 . . . . 0.0 111.569 176.322 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 9.7 tp -61.66 -49.45 76.47 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 119.666 1.121 . . . . 0.0 110.097 175.781 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 3.1 mp -64.25 -33.58 76.13 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.883 -0.579 . . . . 0.0 111.818 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -68.87 -45.78 70.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.734 0.814 . . . . 0.0 108.836 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -63.59 -17.17 62.58 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.952 -1.093 . . . . 0.0 113.04 174.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.5 m-85 -110.81 13.6 22.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.315 1.446 . . . . 0.0 109.1 177.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -56.19 129.45 40.22 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 119.576 -1.952 . . . . 0.0 109.133 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 78.64 8.2 87.79 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 118.979 -0.901 . . . . 0.0 113.967 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 52.6 m -92.5 146.85 23.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.058 1.429 . . . . 0.0 108.412 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -19.64 54.76 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 121.174 -0.954 . . . . 0.0 111.043 176.207 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -94.22 -18.68 21.45 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.492 1.917 . . . . 0.0 111.508 -179.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.96 -40.75 44.81 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.538 1.135 . . . . 0.0 110.608 176.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.61 66.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.461 2.304 . . . . 0.0 110.081 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 6.8 m -58.51 -54.16 50.21 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 117.061 -1.447 . . . . 0.0 107.285 176.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -53.95 -42.49 68.93 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.76 1.164 . . . . 0.0 110.878 179.421 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -62.58 -46.71 87.1 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.304 1.842 . . . . 0.0 111.405 178.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -32.51 72.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.471 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 31.4 mt -76.44 -22.74 54.24 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.169 174.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.1 t -65.17 -58.8 5.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 121.334 1.879 . . . . 0.0 111.824 -178.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.99 1.38 5.73 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.479 1.511 . . . . 0.0 113.517 175.065 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.7 t90 -71.46 86.15 0.85 Allowed 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.428 1.091 . . . . 0.0 109.591 -173.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.19 -12.7 19.36 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.719 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.63 -13.65 0.7 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 128.028 2.531 . . . . 0.0 114.159 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.457 HD13 ' CD2' ' A' ' 457' ' ' LEU . 4.3 mt -57.61 -78.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 C-N-CA 128.406 2.682 . . . . 0.0 111.685 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -171.28 -86.7 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 124.166 1.936 . . . . 0.0 114.165 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -157.84 158.15 34.61 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 127.048 2.139 . . . . 0.0 111.649 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -27.54 69.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 119.175 0.898 . . . . 0.0 112.746 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -71.36 -50.97 26.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.077 1.308 . . . . 0.0 109.416 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 10.5 mt -74.46 -4.17 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.584 1.554 . . . . 0.0 109.857 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.03 -63.35 1.33 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.553 1.07 . . . . 0.0 108.715 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -51.62 -43.75 62.68 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 122.7 0.4 . . . . 0.0 110.215 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -54.06 51.26 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.568 0.747 . . . . 0.0 111.399 175.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 57.8 m -57.23 -35.74 70.05 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.512 1.125 . . . . 0.0 110.641 176.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . 0.45 ' CG ' HD12 ' A' ' 464' ' ' LEU . 87.5 t80 -67.12 -57.9 5.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.095 0.862 . . . . 0.0 111.077 177.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.8 m -54.69 -45.03 73.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.069 -0.967 . . . . 0.0 109.183 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -62.0 -38.85 90.18 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.315 0.961 . . . . 0.0 110.575 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.6 t -62.98 -56.98 12.36 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.081 1.352 . . . . 0.0 110.672 174.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -49.09 -48.22 44.49 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.678 1.191 . . . . 0.0 108.19 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -57.9 -49.62 76.11 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -61.57 -35.27 77.32 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.777 1.231 . . . . 0.0 113.033 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.23 28.65 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 173.392 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 -59.89 -43.14 94.95 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.285 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.4 -51.64 66.17 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 110.206 174.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 14.8 t -52.08 -49.31 63.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.295 1.038 . . . . 0.0 110.194 173.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 33.0 mt -67.13 -39.67 86.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.652 -174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.63 -43.67 88.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 126.307 1.843 . . . . 0.0 109.696 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.06 -51.47 69.05 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 126.245 1.818 . . . . 0.0 109.298 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 4.5 mt -55.26 -51.6 66.11 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.74 1.216 . . . . 0.0 108.994 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.9 ttm-85 -58.82 -53.39 58.95 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.709 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -48.85 -51.81 27.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.827 1.251 . . . . 0.0 109.403 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.04 -38.53 82.63 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.467 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -50.83 70.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.106 1.762 . . . . 0.0 108.939 176.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 2.5 mt -57.9 -53.31 59.65 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.973 1.709 . . . . 0.0 108.96 176.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.5 -35.44 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 121.134 1.788 . . . . 0.0 109.985 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.17 -24.78 67.8 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.658 -1.276 . . . . 0.0 110.754 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -96.5 -1.54 47.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 116.179 -1.867 . . . . 0.0 109.773 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -43.11 14.2 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 122.974 2.625 . . . . 0.0 111.119 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -72.05 -3.76 24.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.601 2.36 . . . . 0.0 115.034 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -138.63 -89.31 0.22 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -176.911 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -48.49 -41.46 29.94 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.21 1.804 . . . . 0.0 112.054 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 72.36 80.04 0.42 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 109.08 -1.608 . . . . 0.0 109.08 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.45 158.27 0.29 Allowed 'General case' 0 C--O 1.238 0.487 0 O-C-N 124.937 1.022 . . . . 0.0 109.823 172.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.84 160.87 25.11 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.036 0.922 . . . . 0.0 110.489 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -37.84 74.22 Favored 'General case' 0 N--CA 1.458 -0.035 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.792 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.87 -53.34 57.08 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 125.717 1.607 . . . . 0.0 110.189 175.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -40.92 73.15 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.293 1.406 . . . . 0.0 112.457 174.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -63.1 -37.36 86.9 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.381 -1.45 . . . . 0.0 110.158 176.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 4.8 mt -71.13 -38.84 72.28 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.042 -1.456 . . . . 0.0 108.958 177.307 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -50.91 -44.12 59.96 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.424 1.011 . . . . 0.0 109.361 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.58 -41.34 76.78 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 117.053 -1.451 . . . . 0.0 114.331 173.485 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -45.66 91.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 121.982 2.174 . . . . 0.0 107.085 179.482 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -54.11 49.88 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -41.77 66.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.038 1.735 . . . . 0.0 111.825 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.22 -39.7 89.78 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.55 -1.344 . . . . 0.0 109.885 -177.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -74.7 -21.42 59.4 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.152 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -81.15 -34.63 32.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.485 1.514 . . . . 0.0 111.359 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.47 -27.3 37.87 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.959 1.304 . . . . 0.0 111.464 174.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 48.94 67.97 0.78 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 126.237 1.815 . . . . 0.0 111.373 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -102.15 154.05 19.37 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.637 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 C--O 1.238 0.494 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 173.305 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 12.8 mttt . . . . . 0 N--CA 1.462 0.152 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.613 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.52 177.65 0.57 Allowed 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 127.612 2.365 . . . . 0.0 106.505 -177.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 77.1 m 64.02 112.68 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 O-C-N 126.048 2.092 . . . . 0.0 109.224 -179.767 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 24.5 m -135.27 162.04 33.68 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 119.997 -1.69 . . . . 0.0 107.731 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -28.84 9.89 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.636 1.574 . . . . 0.0 112.963 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -42.53 78.27 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 116.1 -1.905 . . . . 0.0 109.246 173.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . 0.439 HD12 ' CH2' ' A' ' 522' ' ' TRP . 5.6 mm -58.24 -52.88 53.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 178.149 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.2 mt -50.88 -47.67 60.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 120.2 1.363 . . . . 0.0 110.264 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 56.5 mt -62.35 -58.07 9.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 124.969 1.307 . . . . 0.0 110.765 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -58.81 -37.52 90.51 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.885 2.183 . . . . 0.0 112.022 -177.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 81.1 mt -65.89 -41.95 90.9 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 117.523 -1.227 . . . . 0.0 108.838 173.587 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -30.3 68.19 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 120.202 1.365 . . . . 0.0 111.375 175.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 17.4 t -64.11 -54.8 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 124.582 1.153 . . . . 0.0 109.239 177.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -80.16 -10.12 59.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.916 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -138.17 74.11 43.17 Favored Pre-proline 0 N--CA 1.448 -0.528 0 C-N-CA 123.371 0.668 . . . . 0.0 110.783 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -65.55 -18.45 59.36 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.881 1.721 . . . . 0.0 112.066 -177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.23 -20.68 61.51 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 123.839 0.856 . . . . 0.0 110.329 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.404 HD12 ' CG ' ' A' ' 535' ' ' PHE . 27.3 mt -62.68 -12.81 25.87 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.926 1.694 . . . . 0.0 110.029 176.593 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.87 74.54 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.015 0.926 . . . . 0.0 111.13 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 51.6 m -78.59 -17.04 56.69 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.685 1.13 . . . . 0.0 111.262 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.52 -23.37 22.06 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.753 1.221 . . . . 0.0 110.821 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -78.54 150.78 76.79 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 118.54 0.609 . . . . 0.0 109.464 -179.529 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -75.56 168.31 24.7 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.435 2.09 . . . . 0.0 112.124 176.172 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.49 3.87 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.703 3.602 . . . . 0.0 113.647 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.2 mp 68.54 63.47 0.34 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.604 1.962 . . . . 0.0 110.739 176.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -89.74 -38.98 13.45 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.779 0.8 . . . . 0.0 111.138 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -108.39 0.56 21.19 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.452 2.701 . . . . 0.0 110.808 -176.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.456 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.7 mm? -84.16 -91.15 0.09 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.247 -2.872 . . . . 0.0 103.247 -177.199 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 41.6 t0 65.02 150.36 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.764 1.626 . . . . 0.0 110.72 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 12.2 mt-10 -78.63 -17.97 55.21 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 120.147 -1.596 . . . . 0.0 109.072 -179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.33 -31.47 70.32 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.195 1.398 . . . . 0.0 111.216 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -94.93 -27.43 15.68 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.748 175.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -125.06 89.01 53.34 Favored Pre-proline 0 C--O 1.237 0.433 0 CA-C-N 119.321 0.964 . . . . 0.0 110.801 -176.044 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.96 76.51 0.83 Allowed 'Trans proline' 0 CA--C 1.541 0.865 1 C-N-CA 125.962 4.442 . . . . 0.0 110.378 -175.175 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 144.7 -19.09 2.01 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.884 1.707 . . . . 0.0 113.905 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.94 -25.12 66.57 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 116.973 -1.489 . . . . 0.0 109.543 173.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -44.22 -42.32 6.82 Favored Glycine 0 C--O 1.217 -0.928 0 CA-C-N 120.449 1.477 . . . . 0.0 110.763 174.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 33.1 tp -58.17 -51.09 71.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.554 1.177 . . . . 0.0 112.643 176.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -58.2 -52.46 65.49 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 126.303 1.841 . . . . 0.0 110.79 173.665 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -53.35 -51.58 62.01 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.671 1.588 . . . . 0.0 108.58 -179.738 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.39 -42.42 83.37 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.23 1.412 . . . . 0.0 109.974 -176.705 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -57.78 -48.69 78.95 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 124.481 1.112 . . . . 0.0 110.615 177.131 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 84.5 t -63.62 -48.12 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 117.756 -1.116 . . . . 0.0 108.356 175.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -52.34 -41.65 63.21 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.117 1.326 . . . . 0.0 109.77 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.9 m -72.01 -42.16 66.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 126.513 1.925 . . . . 0.0 112.019 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.7 m -62.56 -39.77 94.73 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.199 1.363 . . . . 0.0 110.549 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -24.26 67.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.914 1.686 . . . . 0.0 111.975 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.58 -56.71 4.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.518 1.527 . . . . 0.0 107.997 174.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.9 100.0 0.23 Allowed Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 124.353 1.061 . . . . 0.0 111.267 -173.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.28 138.25 75.92 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 N-CA-C 107.274 -1.856 . . . . 0.0 107.274 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 55.93 36.61 67.36 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 124.528 1.061 . . . . 0.0 112.833 173.692 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 7.2 tp -64.28 151.62 43.25 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -177.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.78 163.81 19.51 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.309 2.243 . . . . 0.0 107.665 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 91.6 m -58.57 -44.03 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.208 1.003 . . . . 0.0 111.18 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.46 -34.04 60.73 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -67.38 -29.0 68.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.616 1.208 . . . . 0.0 111.531 -177.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 13.8 tp -58.87 -51.96 67.78 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.65 -30.22 67.15 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.454 0.702 . . . . 0.0 111.569 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -71.86 -43.73 64.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.11 0.868 . . . . 0.0 112.468 176.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -63.86 -18.28 64.0 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.078 1.751 . . . . 0.0 111.859 173.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -117.58 17.71 14.39 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.697 1.999 . . . . 0.0 110.688 179.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -62.03 -19.22 62.65 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 121.357 1.89 . . . . 0.0 114.158 -176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -136.06 42.26 1.34 Allowed Glycine 0 C--O 1.227 -0.311 0 C-N-CA 124.996 1.284 . . . . 0.0 110.852 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 48.7 m -108.09 145.99 33.26 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -21.35 65.39 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 121.217 -0.927 . . . . 0.0 112.011 174.524 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -88.95 -26.28 21.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 130.817 3.647 . . . . 0.0 109.675 179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -40.49 -43.89 1.93 Allowed 'General case' 0 C--O 1.206 -1.203 0 C-N-CA 124.24 1.016 . . . . 0.0 110.426 178.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.77 -52.63 47.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.876 1.67 . . . . 0.0 113.217 176.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 89.7 m -63.73 -45.21 90.91 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 124.842 1.257 . . . . 0.0 109.693 174.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 42.9 mt -60.52 -34.52 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.292 1.037 . . . . 0.0 111.21 177.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -40.77 64.46 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 127.04 2.136 . . . . 0.0 109.412 -178.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -64.55 -37.94 89.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . 0.523 HD21 ' CE3' ' A' ' 522' ' ' TRP . 88.0 mt -77.32 -10.9 59.72 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 118.395 -0.812 . . . . 0.0 112.515 173.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 9.4 t -69.92 -66.04 0.64 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.192 1.397 . . . . 0.0 108.388 177.786 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.38 14.36 2.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.459 1.904 . . . . 0.0 111.742 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . 0.523 ' CE3' HD21 ' A' ' 519' ' ' LEU . 4.4 t90 -53.69 123.97 13.8 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -28.62 15.55 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.281 -173.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -49.75 -30.26 9.12 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 125.502 1.521 . . . . 0.0 111.031 -177.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.6 pt -110.27 -70.84 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 130.834 3.654 . . . . 0.0 112.457 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.38 52.09 3.67 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 126.877 2.071 . . . . 0.0 112.311 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -151.11 150.21 30.41 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.61 -174.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -106.88 -27.71 10.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.364 1.066 . . . . 0.0 111.983 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -87.66 -60.75 1.89 Allowed 'General case' 0 CA--C 1.51 -0.584 0 C-N-CA 124.567 1.147 . . . . 0.0 108.936 -177.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 45.0 mt -55.55 -28.12 22.35 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.69 -60.32 3.16 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.814 1.246 . . . . 0.0 111.206 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -52.74 -42.97 65.41 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 119.058 0.844 . . . . 0.0 110.602 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -49.48 69.64 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.31 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 61.2 m -58.94 -31.37 68.63 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.156 1.782 . . . . 0.0 107.75 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . 0.404 ' CG ' HD12 ' A' ' 464' ' ' LEU . 39.4 t80 -66.55 -58.05 6.0 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 109.551 178.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 80.6 m -63.23 -39.6 95.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.706 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -60.02 -45.18 93.62 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.467 1.107 . . . . 0.0 108.361 175.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.7 t -70.4 -51.77 27.23 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.479 -1.388 . . . . 0.0 112.002 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.3 tt -46.8 -49.94 19.13 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 126.708 2.003 . . . . 0.0 111.083 170.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.267 0.9 OUTLIER -65.68 -33.56 76.18 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-O 116.04 -1.933 . . . . 0.0 110.342 179.071 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -72.04 -35.45 69.35 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.049 1.295 . . . . 0.0 110.36 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -57.72 9.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.456 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.5 m-85 -58.76 -42.38 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 126.487 1.915 . . . . 0.0 111.343 -177.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.68 -49.14 78.66 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 127.551 2.341 . . . . 0.0 109.096 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.6 t -56.59 -35.62 68.44 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.626 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 16.2 mt -74.0 -40.82 62.67 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.712 1.205 . . . . 0.0 111.087 179.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 30.8 mt -61.7 -44.86 96.13 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 117.517 -1.23 . . . . 0.0 109.0 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.046 0.938 . . . . 0.0 111.476 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.33 -45.55 72.69 Favored 'General case' 0 CA--C 1.451 -2.85 0 C-N-CA 124.493 1.117 . . . . 0.0 111.346 173.704 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.3 ttm-85 -63.98 -51.07 66.01 Favored 'General case' 0 C--N 1.272 -2.777 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.69 -51.95 52.04 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.654 1.182 . . . . 0.0 109.149 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.89 -43.24 99.26 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.063 -176.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -40.21 95.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.196 1.798 . . . . 0.0 110.373 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 4.2 mt -60.72 -55.13 36.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.697 1.199 . . . . 0.0 107.835 174.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.9 mm -61.57 -39.54 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 120.255 1.389 . . . . 0.0 111.763 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -60.25 -18.29 47.87 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.503 1.521 . . . . 0.0 109.542 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.18 18.49 12.19 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 120.577 1.535 . . . . 0.0 111.39 173.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.85 -63.83 1.4 Allowed 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 121.164 1.802 . . . . 0.0 109.523 177.321 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -8.8 53.51 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.181 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.05 -43.01 3.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.358 1.435 . . . . 0.0 109.886 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -115.06 -74.18 0.62 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.495 1.518 . . . . 0.0 109.09 -173.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 148.62 109.18 0.52 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -79.78 132.74 36.22 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.3 t -66.57 165.32 14.86 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.88 -39.9 86.87 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.759 . . . . 0.0 110.624 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.73 -51.56 26.56 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 123.995 0.918 . . . . 0.0 109.343 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -59.0 -30.4 67.96 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 123.793 1.759 . . . . 0.0 111.526 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.97 -38.37 72.78 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 118.785 -2.447 . . . . 0.0 106.147 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 18.4 mt -67.76 -32.9 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.487 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.5 -43.55 62.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.131 1.332 . . . . 0.0 108.912 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -61.78 -39.84 93.1 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 117.423 -1.275 . . . . 0.0 112.803 177.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -50.48 72.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.166 1.803 . . . . 0.0 108.172 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -35.91 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 124.146 0.904 . . . . 0.0 109.404 -175.159 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -52.61 37.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.789 1.636 . . . . 0.0 110.95 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -57.4 -46.22 83.7 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.464 1.906 . . . . 0.0 111.468 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.8 -24.72 65.33 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 111.66 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.21 -33.89 43.36 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 119.257 0.935 . . . . 0.0 109.346 173.757 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.83 -25.49 44.12 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 128.024 2.53 . . . . 0.0 109.869 -176.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -53.56 -48.1 69.43 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.776 1.23 . . . . 0.0 111.73 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.45 -59.86 0.27 Allowed 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.306 175.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.628 0 CA-C-O 114.231 -2.795 . . . . 0.0 104.569 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.433 ' HE2' ' NE2' ' A' ' 541' ' ' HIS . 3.4 tmtm? . . . . . 0 C--O 1.238 0.499 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 47.9 ttt180 -77.96 69.84 4.25 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.1 m -143.4 148.92 36.92 Favored 'General case' 0 N--CA 1.434 -1.26 0 C-N-CA 125.307 1.443 . . . . 0.0 108.139 -173.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.45 -91.86 0.55 Allowed 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 46.5 ttm -164.53 -40.39 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.386 1.075 . . . . 0.0 109.024 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -56.02 -19.23 11.85 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.26 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.4 mm -51.99 -52.14 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 125.167 1.387 . . . . 0.0 109.409 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.54 -42.71 67.76 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.494 0.588 . . . . 0.0 111.517 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 43.8 mt -69.39 -53.08 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.227 0.611 . . . . 0.0 109.553 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -64.18 -43.43 97.12 Favored Glycine 0 C--N 1.336 0.534 0 CA-C-N 118.749 0.704 . . . . 0.0 112.679 -173.898 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.22 -41.68 96.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.154 177.353 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -64.77 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.83 0.741 . . . . 0.0 110.68 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.63 -50.96 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 121.599 -0.688 . . . . 0.0 109.541 173.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -72.59 -28.63 62.91 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.293 -174.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -133.55 84.47 45.61 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 126.895 2.078 . . . . 0.0 111.643 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -65.36 -21.48 61.03 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 121.945 1.763 . . . . 0.0 113.3 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.64 -17.02 62.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.069 0.849 . . . . 0.0 111.278 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.41 -15.58 58.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.207 -0.933 . . . . 0.0 110.673 173.77 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.77 -25.47 67.27 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 119.452 1.024 . . . . 0.0 111.047 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 7.9 m -83.41 -12.82 56.01 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.066 0.946 . . . . 0.0 110.789 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 20.8 mt -103.17 -7.55 21.15 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 112.478 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 14.9 p -92.32 137.89 24.5 Favored Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 119.995 1.27 . . . . 0.0 109.692 -177.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.05 164.72 24.0 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.17 2.58 . . . . 0.0 110.355 173.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.72 16.57 0.27 Allowed 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 123.474 2.783 . . . . 0.0 115.515 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.38 16.4 8.3 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 128.367 2.667 . . . . 0.0 113.249 175.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -57.79 -20.26 34.11 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.129 2.572 . . . . 0.0 115.396 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.3 10.08 19.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.34 1.456 . . . . 0.0 111.826 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 5.1 mp -124.13 -58.21 1.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.047 0.939 . . . . 0.0 111.731 -173.463 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 25.8 t0 64.59 157.25 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.533 1.533 . . . . 0.0 108.866 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -75.27 -21.96 58.14 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 119.711 -1.868 . . . . 0.0 107.576 173.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -61.8 -49.21 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.291 2.237 . . . . 0.0 113.202 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 48.0 mmtt -77.21 -20.31 55.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.715 -0.659 . . . . 0.0 112.497 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -120.78 88.29 43.69 Favored Pre-proline 0 N--CA 1.453 -0.282 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.53 87.95 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.99 2.46 . . . . 0.0 111.307 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.46 -19.02 2.82 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.276 1.893 . . . . 0.0 112.589 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 8.7 tt -62.77 -25.1 68.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.822 1.311 . . . . 0.0 111.499 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.66 -40.06 17.12 Favored Glycine 0 CA--C 1.527 0.822 0 CA-C-N 118.607 0.64 . . . . 0.0 112.054 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.89 -40.91 97.62 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.735 1.267 . . . . 0.0 112.696 174.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -61.86 -42.59 99.23 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.716 -1.24 . . . . 0.0 109.074 174.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -61.91 -47.56 84.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.294 1.038 . . . . 0.0 110.76 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.23 -56.44 14.67 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 127.238 2.215 . . . . 0.0 109.473 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.8 mp -56.25 -59.68 4.59 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.586 1.155 . . . . 0.0 109.784 -178.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 72.6 t -54.68 -42.86 63.38 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.164 0 C-N-CA 123.361 0.664 . . . . 0.0 109.628 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -59.64 -44.8 93.36 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 119.131 0.878 . . . . 0.0 110.798 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.5 m -63.76 -41.61 97.96 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 123.503 0.721 . . . . 0.0 109.898 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 88.5 m -62.97 -44.49 95.91 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 119.002 0.819 . . . . 0.0 110.074 -177.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -18.46 47.05 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.748 1.219 . . . . 0.0 112.817 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.8 t -99.46 -11.84 20.73 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.901 1.68 . . . . 0.0 113.023 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -106.29 90.69 4.95 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 125.234 1.414 . . . . 0.0 109.791 -176.644 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.23 122.7 10.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.845 1.697 . . . . 0.0 110.082 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 75.41 30.45 58.48 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 119.481 -0.622 . . . . 0.0 112.406 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 37.9 tp -56.07 153.3 9.18 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.81 0.805 . . . . 0.0 110.065 174.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -136.29 166.61 23.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.4 m -47.02 -49.99 20.15 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.098 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.32 -33.46 19.98 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -64.63 -27.19 68.77 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.373 0.669 . . . . 0.0 110.356 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.5 -48.65 74.38 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.358 0.663 . . . . 0.0 109.999 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.7 mp -62.67 -31.11 71.94 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.969 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -68.62 -48.84 63.07 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.693 0.679 . . . . 0.0 109.711 173.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -65.83 -20.66 66.32 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.688 -0.632 . . . . 0.0 112.349 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -107.11 8.81 30.39 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.977 0.911 . . . . 0.0 110.773 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.24 -14.88 12.43 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -173.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -118.54 12.29 12.27 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.722 1.153 . . . . 0.0 113.67 174.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.536 HG21 ' H ' ' A' ' 512' ' ' ASN . 90.8 m -94.06 146.97 23.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 119.849 1.825 . . . . 0.0 110.652 -174.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -9.87 9.8 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.396 1.078 . . . . 0.0 112.7 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.536 ' H ' HG21 ' A' ' 510' ' ' THR . 2.2 t-20 -94.82 -16.51 22.89 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.962 2.105 . . . . 0.0 112.201 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.45 -48.06 7.15 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.626 1.17 . . . . 0.0 113.232 -175.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.08 -43.92 87.29 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.311 0.505 . . . . 0.0 111.876 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.3 m -66.87 -37.91 85.32 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.722 -0.611 . . . . 0.0 110.726 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.37 -45.33 73.09 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.29 1.036 . . . . 0.0 110.965 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.24 -44.76 95.82 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -60.98 -35.39 76.68 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.857 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 39.8 mt -74.94 -27.14 60.07 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.412 1.46 . . . . 0.0 112.832 175.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 1.2 t -62.64 -47.23 84.63 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.86 12.99 11.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.635 1.574 . . . . 0.0 114.188 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -65.91 125.45 25.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.851 0.834 . . . . 0.0 111.732 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -81.44 -25.17 36.35 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 130.979 3.712 . . . . 0.0 114.308 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.64 -20.15 65.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.544 0.737 . . . . 0.0 112.331 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 4.9 pt -125.76 -64.62 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.268 1.027 . . . . 0.0 110.692 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 50.38 3.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 129.823 3.249 . . . . 0.0 118.179 174.459 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -114.92 164.84 13.57 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.724 1.147 . . . . 0.0 110.798 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.2 pttt -118.3 -13.43 9.84 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.942 1.697 . . . . 0.0 113.097 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.67 -53.56 4.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 120.44 1.473 . . . . 0.0 108.394 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.11 -24.39 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.149 1.779 . . . . 0.0 109.213 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.54 -45.34 66.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.455 1.102 . . . . 0.0 112.316 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -63.06 -51.6 66.03 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.364 0.984 . . . . 0.0 109.155 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -55.19 -44.76 75.59 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.378 0.671 . . . . 0.0 110.469 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.6 m -71.58 -29.69 65.0 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.652 0.781 . . . . 0.0 111.423 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -69.04 -51.42 39.21 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.69 1.132 . . . . 0.0 108.09 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 82.6 m -54.17 -45.45 72.09 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.305 1.042 . . . . 0.0 109.39 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -62.79 -47.72 82.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.043 0.838 . . . . 0.0 110.813 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -43.73 79.82 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.94 -52.52 62.71 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.991 0.917 . . . . 0.0 108.574 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -58.55 -45.11 89.63 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.963 0.905 . . . . 0.0 110.681 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . 0.433 ' NE2' ' HE2' ' A' ' 447' ' ' LYS . 7.3 t60 -69.42 -35.04 75.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 119.414 1.006 . . . . 0.0 110.688 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -56.05 24.71 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 173.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 10.7 m-85 -61.97 -48.34 80.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.931 0.893 . . . . 0.0 110.474 -176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -55.67 -42.13 74.68 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.035 2.134 . . . . 0.0 111.787 176.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.8 t -67.08 -39.49 86.83 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.49 0.716 . . . . 0.0 111.764 174.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 41.8 mt -68.23 -38.37 81.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.434 -0.791 . . . . 0.0 109.908 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -46.35 88.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 109.001 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -64.2 -43.25 95.61 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.405 0.682 . . . . 0.0 111.131 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.84 -49.22 77.14 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.948 -1.095 . . . . 0.0 111.203 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 38.4 ttt-85 -57.8 -40.41 79.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 124.456 1.102 . . . . 0.0 109.668 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -56.09 -49.21 74.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.248 174.01 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -66.88 -36.98 83.55 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.048 1.295 . . . . 0.0 111.41 -175.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -55.19 -52.36 63.58 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.209 1.404 . . . . 0.0 109.766 174.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 13.8 mt -60.86 -55.42 33.22 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.11 0.964 . . . . 0.0 110.332 177.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.5 mm -63.61 -31.81 54.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 O-C-N 121.726 -0.609 . . . . 0.0 109.972 -174.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.36 97.5 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.306 0.957 . . . . 0.0 109.927 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -69.06 -23.83 64.09 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 116.368 -1.777 . . . . 0.0 110.968 173.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.08 -41.0 74.67 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.795 2.543 . . . . 0.0 109.863 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -75.91 5.1 6.94 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -174.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.509 HG21 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.18 -79.98 0.14 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 119.176 0.898 . . . . 0.0 109.633 175.093 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.509 ' H ' HG21 ' A' ' 560' ' ' THR . 5.8 t-80 -47.39 -48.12 26.17 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 127.666 2.386 . . . . 0.0 113.662 -173.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 84.99 87.53 0.91 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 -173.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.3 172.52 11.03 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.78 158.7 24.18 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.268 0.627 . . . . 0.0 110.001 -175.645 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.46 -41.14 89.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.317 0.58 . . . . 0.0 109.44 174.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . 0.457 ' CD ' ' H ' ' A' ' 566' ' ' GLU . 23.5 mp0 -57.08 -52.9 63.44 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 129.068 2.947 . . . . 0.0 107.784 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -62.61 -39.94 95.38 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.554 1.542 . . . . 0.0 111.394 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.73 -23.75 63.44 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.177 -1.577 . . . . 0.0 110.271 177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 57.0 mt -84.52 -38.99 19.37 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.145 1.378 . . . . 0.0 110.26 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -50.95 -44.49 60.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.844 1.202 . . . . 0.0 108.619 174.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 17.5 mt -53.55 -40.95 65.96 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.999 0.92 . . . . 0.0 112.874 174.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 121.102 1.774 . . . . 0.0 109.21 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.2 m -56.69 -52.96 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.476 1.11 . . . . 0.0 108.776 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.9 tp -52.81 -47.95 67.26 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.561 1.545 . . . . 0.0 111.042 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -60.23 -37.82 81.52 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.711 0.804 . . . . 0.0 112.31 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -80.03 -35.74 36.8 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.426 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.76 -31.89 72.1 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.566 0.746 . . . . 0.0 109.9 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 32.1 mt -80.73 -15.14 57.26 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.071 0.948 . . . . 0.0 110.638 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 41.44 48.92 3.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.985 2.114 . . . . 0.0 112.133 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -129.99 169.25 15.49 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.283 1.033 . . . . 0.0 109.884 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 80.7 tttt . . . . . 0 C--O 1.235 0.303 0 C-N-CA 124.335 1.054 . . . . 0.0 108.668 -179.607 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.42 138.37 58.26 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.452 1.095 . . . . 0.0 110.357 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 92.6 m 65.62 123.39 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.407 1.067 . . . . 0.0 110.403 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 97.7 m -155.97 162.29 40.38 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.568 1.168 . . . . 0.0 110.417 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptm -55.0 -17.62 4.0 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.604 1.19 . . . . 0.0 111.037 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 23.5 mtt85 -74.9 -21.99 58.89 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.535 1.147 . . . . 0.0 110.34 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . 0.562 HD12 ' CH2' ' A' ' 522' ' ' TRP . 1.8 mm -75.14 -45.43 41.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.506 1.129 . . . . 0.0 109.346 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . 0.47 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 4.1 mm? -59.14 -47.23 86.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.578 1.174 . . . . 0.0 109.298 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . 0.466 ' O ' ' N ' ' A' ' 459' ' ' VAL . 24.3 mt -72.79 -54.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.134 . . . . 0.0 109.265 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -45.46 -49.27 11.36 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.552 1.157 . . . . 0.0 111.005 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 461' ' ' ASN . 38.3 mt -66.1 -42.7 88.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.452 0.737 . . . . 0.0 109.33 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -64.81 -26.91 68.55 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.517 1.136 . . . . 0.0 109.372 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.482 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 3.6 t -69.56 -52.56 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.446 1.091 . . . . 0.0 109.342 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . 0.4 ' O ' ' OG1' ' A' ' 500' ' ' THR . 4.4 mt-30 -75.49 -27.45 58.81 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.477 1.11 . . . . 0.0 110.23 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . 0.441 ' N ' ' O ' ' A' ' 457' ' ' LEU . 0.3 OUTLIER -129.6 90.04 45.01 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.513 1.133 . . . . 0.0 109.269 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 -13.81 21.2 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.451 1.764 . . . . 0.0 111.028 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -77.11 -9.41 58.72 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.497 1.123 . . . . 0.0 110.311 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.574 ' HB3' ' CZ ' ' A' ' 535' ' ' PHE . 18.7 mt -75.7 -15.16 60.33 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.443 1.089 . . . . 0.0 109.269 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -62.01 -31.53 71.92 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.517 1.136 . . . . 0.0 109.342 180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 2.6 m -76.72 -13.22 60.06 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.53 1.144 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . 0.4 HD13 ' CD2' ' A' ' 464' ' ' LEU . 19.5 mt -97.07 -9.12 28.69 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.53 1.144 . . . . 0.0 109.232 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . 0.534 ' CG1' HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -97.62 146.43 31.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.483 1.114 . . . . 0.0 109.322 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . 0.517 ' HD2' ' CG2' ' A' ' 468' ' ' VAL . 18.3 Cg_endo -75.01 175.29 11.44 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 124.457 1.767 . . . . 0.0 111.034 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . 0.431 ' O ' ' HB2' ' A' ' 471' ' ' LEU . 18.5 Cg_endo -74.96 5.29 4.05 Favored 'Trans proline' 0 C--N 1.358 1.075 0 O-C-N 124.488 1.783 . . . . 0.0 111.018 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . 0.506 ' CD1' ' CD1' ' A' ' 474' ' ' LEU . 3.4 mm? 68.63 70.49 0.29 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.484 1.115 . . . . 0.0 109.301 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.68 -62.51 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 0.0 110.296 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.88 -1.39 34.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.125 . . . . 0.0 109.319 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.506 ' CD1' ' CD1' ' A' ' 471' ' ' LEU . 7.6 mt -90.88 -61.97 1.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 1.191 . . . . 0.0 109.261 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 15.8 t0 60.77 152.81 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.498 1.124 . . . . 0.0 109.215 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -90.42 15.84 9.92 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.468 1.105 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -111.65 -34.04 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.49 1.119 . . . . 0.0 109.328 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -81.05 -21.17 40.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 0.0 109.317 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . 0.456 ' CB ' ' HB2' ' A' ' 482' ' ' LEU . 46.4 mt -126.03 106.03 25.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.547 1.154 . . . . 0.0 109.313 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 73.98 4.17 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.502 1.79 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 152.18 -21.38 0.86 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.895 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . 0.456 ' HB2' ' CB ' ' A' ' 479' ' ' LEU . 2.1 tm? -54.3 -35.82 63.03 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 0.78 . . . . 0.0 109.336 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.29 -50.97 9.52 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.508 1.13 . . . . 0.0 111.047 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.47 -46.49 73.37 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.447 0.734 . . . . 0.0 109.348 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . 0.47 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 46.8 t80 -65.55 -40.35 92.75 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . 0.447 ' HB2' ' CD1' ' A' ' 482' ' ' LEU . 2.8 ttt85 -66.52 -49.12 67.56 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.511 1.132 . . . . 0.0 110.333 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.6 -47.22 80.09 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.495 1.122 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . 0.518 HD23 ' CE1' ' A' ' 507' ' ' TYR . 1.4 mt -63.42 -49.69 72.74 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.507 1.129 . . . . 0.0 109.279 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . 0.534 HG11 ' CG1' ' A' ' 468' ' ' VAL . 17.5 t -58.66 -49.75 81.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.529 1.143 . . . . 0.0 109.338 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -53.96 -39.38 65.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.474 1.109 . . . . 0.0 109.338 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 1.1 m -73.71 -44.19 57.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.117 . . . . 0.0 110.384 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . 0.402 ' SG ' ' CD2' ' A' ' 498' ' ' LEU . 66.5 m -56.1 -46.43 79.1 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.508 1.13 . . . . 0.0 108.227 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -22.19 43.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.508 1.13 . . . . 0.0 109.279 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.19 -53.25 5.91 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.572 1.17 . . . . 0.0 109.998 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.573 ' OE1' ' CD2' ' A' ' 506' ' ' HIS . 2.1 mp0 -61.51 110.99 3.62 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.433 1.083 . . . . 0.0 110.285 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 126.25 9.83 Favored 'Trans proline' 0 C--N 1.36 1.135 0 O-C-N 124.47 1.774 . . . . 0.0 110.919 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.06 41.32 99.84 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 124.479 1.112 . . . . 0.0 110.969 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . 0.402 ' CD2' ' SG ' ' A' ' 492' ' ' CYS . 43.2 tp -58.46 164.87 2.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.54 0.788 . . . . 0.0 109.387 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' THR . . . . . 0.409 ' O ' ' HB2' ' A' ' 503' ' ' LEU . 6.3 p -142.95 170.51 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.46 1.1 . . . . 0.0 110.403 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' THR . . . . . 0.4 ' OG1' ' O ' ' A' ' 460' ' ' GLN . 2.3 m -66.56 -35.05 79.27 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.44 1.087 . . . . 0.0 110.372 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -83.92 -55.06 2.88 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.479 1.112 . . . . 0.0 111.033 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -50.81 -29.65 12.2 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.459 0.741 . . . . 0.0 110.287 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . 0.482 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 21.9 tp -56.05 -58.81 6.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 0.0 109.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -56.98 -34.57 68.23 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.409 1.068 . . . . 0.0 109.357 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -64.32 -34.52 78.34 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . 0.573 ' CD2' ' OE1' ' A' ' 495' ' ' GLN . 68.8 t60 -71.69 -13.55 61.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 0.0 109.538 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . 0.518 ' CE1' HD23 ' A' ' 488' ' ' LEU . 37.6 m-85 -124.22 27.24 7.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 0.0 111.071 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.26 126.98 31.21 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.507 1.129 . . . . 0.0 110.352 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.12 29.11 57.27 Favored Glycine 0 CA--C 1.529 0.947 0 O-C-N 124.453 1.095 . . . . 0.0 111.002 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 19.0 m -109.02 136.78 47.97 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 0.763 . . . . 0.0 110.373 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 57.4 m-20 -58.75 -15.7 13.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.0 109.288 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.427 ' OD1' ' N ' ' A' ' 512' ' ' ASN . 0.6 OUTLIER -97.41 -22.42 16.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.483 1.115 . . . . 0.0 109.268 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -47.54 -36.08 9.93 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 0.0 109.263 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.49 41.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.452 1.095 . . . . 0.0 109.291 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 68.6 m -58.32 -42.42 86.7 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.461 1.1 . . . . 0.0 110.361 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . 0.471 HD22 ' CD1' ' A' ' 488' ' ' LEU . 13.6 mt -66.56 -33.64 76.13 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.408 1.067 . . . . 0.0 109.335 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -68.21 -47.72 67.12 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.477 1.111 . . . . 0.0 110.277 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -56.21 -38.64 71.29 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 1.146 . . . . 0.0 109.332 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 94.5 mt -72.4 -21.73 61.23 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.478 1.111 . . . . 0.0 109.31 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.9 t -68.74 -59.33 3.18 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 0.0 110.071 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' MET . . . . . 0.403 ' O ' ' C ' ' A' ' 522' ' ' TRP . 0.3 OUTLIER -77.38 2.18 16.72 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.458 1.099 . . . . 0.0 111.009 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . 0.562 ' CH2' HD12 ' A' ' 453' ' ' ILE . 1.9 t90 -42.07 137.67 1.8 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.146 . . . . 0.0 107.918 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.56 1.89 8.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -66.77 -24.3 66.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.488 1.117 . . . . 0.0 109.402 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.549 HD12 ' CZ3' ' A' ' 522' ' ' TRP . 0.7 OUTLIER -113.46 -59.81 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.484 1.115 . . . . 0.0 109.239 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.36 61.76 2.09 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.448 1.092 . . . . 0.0 109.31 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -161.94 153.21 18.25 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.559 1.162 . . . . 0.0 109.325 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.1 pttt -115.93 -36.98 3.98 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.609 1.193 . . . . 0.0 109.29 -179.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.53 -43.68 38.24 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.426 1.079 . . . . 0.0 109.291 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.0 mt -70.91 -12.39 16.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.461 1.101 . . . . 0.0 109.345 -179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.36 -58.19 9.24 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.44 1.088 . . . . 0.0 109.295 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -53.47 -48.07 69.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.411 1.069 . . . . 0.0 110.299 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -43.63 93.85 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.459 1.1 . . . . 0.0 110.304 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' THR . . . . . 0.44 HG21 ' CD1' ' A' ' 457' ' ' LEU . 3.7 m -66.47 -36.08 81.87 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.429 1.08 . . . . 0.0 110.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . 0.574 ' CZ ' ' HB3' ' A' ' 464' ' ' LEU . 18.9 t80 -61.51 -51.6 67.96 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.565 1.166 . . . . 0.0 111.033 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 53.8 m -64.61 -46.91 80.6 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.517 1.136 . . . . 0.0 110.345 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -58.37 -41.18 84.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.533 1.145 . . . . 0.0 109.286 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.7 t -69.8 -56.49 7.0 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.992 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . 0.547 HD23 ' CE1' ' A' ' 543' ' ' PHE . 0.7 OUTLIER -48.36 -43.54 33.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.483 1.114 . . . . 0.0 109.268 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.14 -38.26 90.42 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.496 1.122 . . . . 0.0 109.321 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -62.71 -46.6 87.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.558 1.161 . . . . 0.0 109.601 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' MET . . . . . 0.415 ' O ' ' HG ' ' A' ' 546' ' ' LEU . 1.1 ttp -63.48 -44.9 93.08 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.478 1.111 . . . . 0.0 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.547 ' CE1' HD23 ' A' ' 539' ' ' LEU . 5.8 m-85 -68.84 -35.13 76.57 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.526 1.141 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.01 -44.85 83.56 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.52 1.138 . . . . 0.0 109.258 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.2 t -52.98 -37.65 61.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 0.0 109.994 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . 0.446 ' CD1' ' HA ' ' A' ' 543' ' ' PHE . 1.2 mt -72.11 -50.58 26.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 0.0 109.234 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 79.1 mt -53.53 -36.15 61.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.542 1.151 . . . . 0.0 109.233 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -59.02 -55.33 36.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.8 -44.12 94.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.531 1.145 . . . . 0.0 109.304 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -48.85 62.59 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.527 1.142 . . . . 0.0 110.378 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . 0.405 ' HG3' ' CD2' ' A' ' 571' ' ' LEU . 27.1 tt0 -52.44 -45.7 66.11 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.528 1.142 . . . . 0.0 110.338 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.94 -47.76 79.2 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.548 1.155 . . . . 0.0 110.306 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -33.74 73.86 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.534 1.146 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.493 ' HB3' ' CD1' ' A' ' 571' ' ' LEU . 0.4 OUTLIER -69.87 -50.28 44.05 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 0.0 109.216 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . 0.465 HG12 ' CD2' ' A' ' 571' ' ' LEU . 28.0 mm -64.25 -30.6 50.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 124.523 1.139 . . . . 0.0 109.248 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' A' ' 560' ' ' THR . . . -57.14 -19.28 19.23 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.488 1.117 . . . . 0.0 109.346 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.8 mmt85 -104.44 3.43 32.17 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.546 1.154 . . . . 0.0 110.293 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . 0.524 ' CA ' HD21 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -104.86 -21.45 13.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.474 1.109 . . . . 0.0 110.298 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -108.83 7.62 26.26 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.609 1.193 . . . . 0.0 110.203 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 556' ' ' ALA . 16.9 p -114.01 -61.71 1.7 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.48 1.113 . . . . 0.0 110.362 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -118.93 -41.55 2.76 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.469 1.105 . . . . 0.0 109.567 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . 0.414 ' HA2' ' HA ' ' A' ' 558' ' ' GLU . . . 105.48 93.5 2.31 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.508 1.13 . . . . 0.0 111.028 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . 0.524 HD21 ' CA ' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -55.83 -174.5 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 0.767 . . . . 0.0 109.265 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.37 145.85 55.64 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.061 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . 0.47 ' O ' ' CD1' ' A' ' 569' ' ' LEU . 0.8 OUTLIER -52.94 -38.73 62.28 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.504 1.128 . . . . 0.0 109.265 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.51 -42.49 78.46 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.462 1.101 . . . . 0.0 110.312 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . 0.448 ' HB3' ' CD1' ' A' ' 563' ' ' LEU . 46.9 mm-40 -67.67 -41.16 84.15 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.557 1.161 . . . . 0.0 110.228 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . 0.517 ' N ' HD13 ' A' ' 563' ' ' LEU . 0.7 OUTLIER -60.56 -36.49 78.61 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.518 1.136 . . . . 0.0 110.217 -179.904 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . 0.484 ' O ' ' CD1' ' A' ' 572' ' ' TRP . 7.6 mp -71.58 -37.62 70.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.493 1.12 . . . . 0.0 109.3 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -51.58 -37.65 50.76 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 110.367 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . 0.493 ' CD1' ' HB3' ' A' ' 554' ' ' LEU . 2.7 mt -60.21 -51.01 71.38 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.435 1.085 . . . . 0.0 109.29 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.603 ' CD2' ' N ' ' A' ' 573' ' ' THR . 0.0 OUTLIER -51.44 -57.55 8.68 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.503 1.127 . . . . 0.0 108.052 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.603 ' N ' ' CD2' ' A' ' 572' ' ' TRP . 1.4 m -55.12 -32.78 62.33 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.569 1.168 . . . . 0.0 110.421 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.5 tp -70.95 -41.41 71.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.359 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -59.6 -33.52 71.58 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 0.0 109.235 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -22.5 65.76 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.0 110.334 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.27 -27.63 24.28 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.586 1.179 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 579' ' ' ALA . 1.9 mt -87.03 -6.73 58.63 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.488 1.118 . . . . 0.0 109.341 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 578' ' ' LEU . . . -40.53 -65.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.546 1.154 . . . . 0.0 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.34 73.51 0.92 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.144 . . . . 0.0 109.378 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 O-C-N 124.472 1.108 . . . . 0.0 109.329 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.5 pttt . . . . . 0 C--O 1.22 -0.459 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? 53.59 -88.65 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.351 1.46 . . . . 0.0 109.466 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 3.7 t -83.25 172.42 12.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 120.347 1.43 . . . . 0.0 109.619 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 3.0 t -161.21 58.06 0.29 Allowed 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.681 1.592 . . . . 0.0 107.663 173.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 44.95 47.02 9.33 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.893 1.277 . . . . 0.0 110.08 -173.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.76 -46.28 0.87 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.024 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 18.7 mm -57.18 -52.4 56.86 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 124.305 1.042 . . . . 0.0 108.247 176.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.0 mt -51.74 -42.61 62.45 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-O 117.835 -1.079 . . . . 0.0 111.413 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 92.9 mt -65.43 -62.68 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 CA-C-N 119.614 1.097 . . . . 0.0 109.945 174.469 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -57.12 -40.59 91.76 Favored Glycine 0 C--N 1.337 0.587 0 CA-C-N 120.073 1.306 . . . . 0.0 113.58 -173.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 26.2 mt -67.42 -45.53 75.84 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . 0.452 HD12 ' HG ' ' A' ' 492' ' ' CYS . 3.4 tm? -63.0 -33.83 76.25 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 119.153 0.888 . . . . 0.0 110.458 176.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . 0.42 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 25.5 t -62.89 -51.52 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.489 -0.757 . . . . 0.0 109.394 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.41 -14.92 60.92 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.743 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -144.81 77.42 13.42 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 126.961 2.104 . . . . 0.0 109.165 -174.108 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.6 -13.75 35.54 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.256 1.971 . . . . 0.0 111.688 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.64 -23.07 63.43 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.701 1.601 . . . . 0.0 110.224 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . 0.402 HD11 ' CD1' ' A' ' 535' ' ' PHE . 56.1 mt -58.77 -18.13 29.2 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.79 1.177 . . . . 0.0 111.022 173.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.3 -19.63 64.77 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.268 -0.895 . . . . 0.0 111.989 173.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 24.0 m -83.67 -18.71 37.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.879 0.872 . . . . 0.0 110.929 174.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 81.9 mt -95.32 -19.15 20.2 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.673 176.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -72.01 150.27 92.53 Favored Pre-proline 0 CA--C 1.552 1.055 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 177.332 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -74.69 172.92 15.28 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.958 3.106 . . . . 0.0 112.021 174.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.32 13.2 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 123.117 2.545 . . . . 0.0 114.339 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 2.6 mm? 61.79 60.59 1.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.262 2.225 . . . . 0.0 112.39 -177.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.55 -68.88 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.353 1.061 . . . . 0.0 109.911 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -71.13 -0.55 9.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 17.7 mt -100.99 -81.72 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.23 1.012 . . . . 0.0 110.473 -175.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.1 t0 62.95 153.28 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.126 1.77 . . . . 0.0 112.37 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -75.49 -22.89 56.81 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.696 -1.253 . . . . 0.0 109.484 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -52.15 -46.57 65.48 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 125.483 1.513 . . . . 0.0 110.674 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -83.07 -29.9 28.43 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 47.0 mt -128.1 98.5 26.78 Favored Pre-proline 0 C--O 1.232 0.167 0 CA-C-N 119.698 1.136 . . . . 0.0 109.738 -173.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.46 -22.67 38.62 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.262 1.975 . . . . 0.0 112.328 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -89.62 -13.95 60.5 Favored Glycine 0 CA--C 1.525 0.716 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.291 174.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.74 -25.56 63.89 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.972 1.386 . . . . 0.0 110.233 175.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.67 -47.01 13.18 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.382 0.992 . . . . 0.0 111.944 173.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 39.8 tp -60.36 -49.56 77.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 117.734 0.767 . . . . 0.0 110.921 174.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -57.66 -51.28 70.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.567 1.076 . . . . 0.0 111.457 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -54.17 -52.77 60.11 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.044 0.937 . . . . 0.0 109.655 176.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -61.87 -43.75 98.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.755 0.707 . . . . 0.0 110.356 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.3 mp -54.99 -56.49 19.1 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.89 175.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 75.6 t -57.25 -47.55 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.601 0.637 . . . . 0.0 109.78 178.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.09 -40.94 77.92 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.477 1.035 . . . . 0.0 109.856 -176.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 13.2 m -69.27 -39.77 78.18 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.226 1.411 . . . . 0.0 111.204 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . 0.452 ' HG ' HD12 ' A' ' 458' ' ' LEU . 99.5 m -62.17 -40.71 96.94 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.047 1.294 . . . . 0.0 110.472 176.051 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.03 -24.55 66.02 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 125.313 1.445 . . . . 0.0 111.113 175.74 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 7.1 t -79.8 -53.41 6.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.808 0.843 . . . . 0.0 110.599 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -68.9 104.64 0.77 Allowed Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 125.516 1.526 . . . . 0.0 110.018 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.23 125.68 12.17 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.261 1.974 . . . . 0.0 109.582 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 64.34 36.15 92.85 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 20.3 tp -57.1 156.21 7.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.653 0.739 . . . . 0.0 109.647 173.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 3.4 p -142.66 168.17 20.35 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.336 1.454 . . . . 0.0 108.193 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -52.3 -46.23 65.85 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.049 0.94 . . . . 0.0 110.738 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -76.69 -43.96 16.99 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -62.32 -27.82 69.31 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.4 1.08 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . 0.42 ' CD2' ' HA ' ' A' ' 459' ' ' VAL . 61.4 tp -59.03 -57.0 15.04 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 124.192 0.997 . . . . 0.0 108.506 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.2 mp -62.44 -31.54 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.535 177.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -63.37 -44.69 94.07 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.35 0.977 . . . . 0.0 110.657 176.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -63.88 -15.13 58.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.53 1.132 . . . . 0.0 111.887 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -116.23 21.61 13.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.982 1.313 . . . . 0.0 110.129 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -57.26 123.0 13.82 Favored 'General case' 0 C--O 1.227 -0.111 0 O-C-N 120.153 -1.592 . . . . 0.0 110.6 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 72.83 31.71 62.0 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.5 -0.611 . . . . 0.0 113.592 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 38.7 m -101.6 148.54 25.1 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.643 1.577 . . . . 0.0 110.073 178.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.24 -15.71 27.15 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.613 -0.679 . . . . 0.0 112.754 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -101.83 -21.46 14.58 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -177.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -44.86 -48.19 11.11 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 119.959 1.254 . . . . 0.0 110.101 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.82 81.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.766 1.167 . . . . 0.0 111.972 -177.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 54.1 m -63.21 -53.06 59.04 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 174.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 54.2 mt -55.14 -39.71 69.76 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 124.525 1.13 . . . . 0.0 110.552 -179.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 9.9 tt0 -68.87 -46.12 69.26 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 127.671 2.388 . . . . 0.0 110.234 179.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -56.8 -42.92 80.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 90.5 mt -78.4 -14.37 59.42 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.378 179.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.1 t -73.03 -28.48 62.37 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.41 1.084 . . . . 0.0 110.432 174.068 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -2.15 21.31 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.095 1.358 . . . . 0.0 112.61 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 24.3 t90 -70.96 83.55 0.67 Allowed 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.8 0.84 . . . . 0.0 109.621 -178.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -1.39 58.01 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.311 2.245 . . . . 0.0 111.312 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.18 51.23 0.67 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.481 2.313 . . . . 0.0 109.878 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 55.0 mt -135.85 -71.37 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.408 2.283 . . . . 0.0 107.542 -173.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -170.67 -89.87 0.01 OUTLIER 'General case' 0 C--N 1.351 0.633 0 C-N-CA 125.968 1.707 . . . . 0.0 110.755 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -164.8 164.54 21.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.897 3.279 . . . . 0.0 107.717 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 10.6 ttmm -62.27 -26.88 68.64 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.306 1.442 . . . . 0.0 110.331 173.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -78.41 -60.57 2.32 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 119.774 1.17 . . . . 0.0 110.386 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.87 -20.9 20.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.528 1.131 . . . . 0.0 110.638 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.44 -43.16 54.94 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.233 174.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -58.34 -48.32 80.93 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.502 1.501 . . . . 0.0 110.098 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -47.16 77.79 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.183 -0.948 . . . . 0.0 110.671 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 87.4 m -63.94 -26.44 68.59 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.159 1.384 . . . . 0.0 111.717 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . 0.402 ' CD1' HD11 ' A' ' 464' ' ' LEU . 88.9 t80 -72.21 -52.98 14.0 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 119.855 1.207 . . . . 0.0 108.68 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 23.1 m -61.86 -40.44 95.34 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 123.788 0.68 . . . . 0.0 110.285 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.02 -43.9 98.21 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.725 1.148 . . . . 0.0 110.847 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.0 t -64.6 -48.32 75.38 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 124.977 1.311 . . . . 0.0 111.895 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.19 -52.03 64.66 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-O 118.019 -0.991 . . . . 0.0 108.535 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -57.46 -41.02 79.76 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 123.933 0.893 . . . . 0.0 111.328 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -63.18 -38.99 93.33 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.144 0.429 . . . . 0.0 110.728 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.11 -51.28 59.42 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 121.595 -0.691 . . . . 0.0 109.704 176.422 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -57.77 -46.94 83.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.586 0.754 . . . . 0.0 110.745 179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -54.99 -50.88 67.88 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.868 2.067 . . . . 0.0 110.025 173.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 12.3 t -53.66 -47.83 70.02 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 123.389 0.676 . . . . 0.0 109.878 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 60.7 mt -67.16 -42.34 84.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 119.292 0.951 . . . . 0.0 110.638 -175.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.49 -38.14 88.88 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.976 0.911 . . . . 0.0 110.158 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -52.22 37.65 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 126.03 1.732 . . . . 0.0 110.003 178.048 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 31.7 mt -52.49 -50.57 62.5 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 125.259 1.423 . . . . 0.0 107.932 173.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -40.21 94.66 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 120.691 -1.255 . . . . 0.0 111.449 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.01 -48.63 80.93 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.441 1.019 . . . . 0.0 108.329 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -42.08 95.44 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.331 -176.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -42.06 94.09 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.005 1.722 . . . . 0.0 110.282 -178.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -73.03 -30.85 64.05 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.367 177.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.1 mm -76.18 -31.98 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 120.127 1.33 . . . . 0.0 110.341 174.334 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.89 -29.99 70.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.469 1.507 . . . . 0.0 108.094 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -90.58 15.37 11.01 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.328 1.451 . . . . 0.0 109.417 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -97.82 -50.58 4.38 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 122.186 2.267 . . . . 0.0 109.674 174.099 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -0.24 12.87 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.033 1.333 . . . . 0.0 113.537 -174.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.563 ' CG2' ' H ' ' A' ' 561' ' ' HIS . 0.0 OUTLIER -131.89 -81.44 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 127.819 2.447 . . . . 0.0 108.984 179.385 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.563 ' H ' ' CG2' ' A' ' 560' ' ' THR . 0.1 OUTLIER -56.12 -77.18 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.549 2.34 . . . . 0.0 106.605 -174.14 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 136.42 124.58 2.37 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.346 1.451 . . . . 0.0 110.027 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.83 176.92 7.35 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.18 175.15 5.56 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.383 173.553 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.72 -42.31 97.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.47 -51.0 11.47 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.913 0.758 . . . . 0.0 108.977 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -59.16 -31.23 68.79 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 120.601 -1.312 . . . . 0.0 112.624 177.464 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -33.28 70.55 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.997 -1.065 . . . . 0.0 109.735 174.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.57 -37.83 80.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 117.74 -1.124 . . . . 0.0 109.251 176.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.45 -41.52 14.02 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.983 1.265 . . . . 0.0 109.931 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.42 -40.81 97.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.737 -1.227 . . . . 0.0 113.585 177.109 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -45.54 91.32 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.82 -30.55 70.76 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 123.773 0.67 . . . . 0.0 110.305 -177.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.7 -36.24 62.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.39 1.476 . . . . 0.0 111.312 174.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -66.15 -34.79 78.84 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.165 -1.584 . . . . 0.0 110.435 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -30.85 63.79 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.459 176.374 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -67.13 -41.92 85.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.662 1.585 . . . . 0.0 111.045 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.14 -10.8 59.78 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.301 0.955 . . . . 0.0 111.884 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 33.93 56.0 0.59 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.972 2.509 . . . . 0.0 114.327 174.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.1 mttm 62.88 75.32 0.4 Allowed 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.523 1.529 . . . . 0.0 109.062 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.0 pttm . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 5.1 ttp85 91.66 59.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 129.605 3.162 . . . . 0.0 111.267 173.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 14.7 t -129.19 -161.75 1.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 0.0 108.328 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 32.6 m -156.87 152.88 27.34 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.751 2.02 . . . . 0.0 106.328 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptt? -51.08 -13.21 0.15 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 126.67 1.988 . . . . 0.0 114.786 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -63.66 -32.73 74.3 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 116.065 -1.922 . . . . 0.0 110.001 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.98 -53.14 46.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 CA-C-N 119.965 1.257 . . . . 0.0 108.749 174.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -44.5 70.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.029 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 93.1 mt -69.98 -53.77 22.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.41 -36.21 83.62 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.462 1.029 . . . . 0.0 113.313 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.3 mt -70.07 -39.08 75.84 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 117.575 0.687 . . . . 0.0 109.657 174.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . 0.51 HD11 ' HG ' ' A' ' 492' ' ' CYS . 3.2 tm? -62.22 -37.68 86.32 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.699 0.681 . . . . 0.0 109.967 174.883 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.1 t -59.18 -51.84 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.474 1.11 . . . . 0.0 109.118 173.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -75.29 -20.19 59.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.106 0.562 . . . . 0.0 111.248 -176.074 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -141.94 80.31 15.62 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 126.436 1.894 . . . . 0.0 110.094 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.62 -23.73 74.8 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.779 1.653 . . . . 0.0 113.612 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -64.36 -12.78 45.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.33 0.968 . . . . 0.0 112.921 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 34.2 mt -64.08 -16.23 61.29 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.673 -1.267 . . . . 0.0 109.564 173.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -61.46 -28.38 69.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.834 0.854 . . . . 0.0 110.873 173.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.9 m -83.86 -14.57 50.87 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.029 0.832 . . . . 0.0 112.15 173.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -92.75 -8.71 43.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 119.389 0.995 . . . . 0.0 111.755 176.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 6.0 p -81.03 149.01 65.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 CA-C-N 120.406 1.457 . . . . 0.0 109.333 178.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.48 170.13 20.09 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.501 2.801 . . . . 0.0 111.446 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -72.6 10.83 0.92 Allowed 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.686 2.924 . . . . 0.0 114.073 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 3.8 mp 74.73 26.45 1.39 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 128.236 2.615 . . . . 0.0 115.088 173.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -55.57 -16.5 4.04 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -175.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.07 16.46 8.48 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.72 1.208 . . . . 0.0 111.555 -178.105 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 4.5 mp -122.88 -56.45 1.76 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.424 1.09 . . . . 0.0 109.156 -173.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . 0.561 ' C ' ' H ' ' A' ' 477' ' ' ASN . 1.3 t70 50.1 24.03 1.3 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.418 1.887 . . . . 0.0 113.106 178.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 53.67 -11.66 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 1 C-N-CA 133.52 4.728 . . . . 0.0 114.169 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . 0.561 ' H ' ' C ' ' A' ' 475' ' ' ASP . 25.6 t30 -88.08 -35.08 17.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 131.512 3.925 . . . . 0.0 111.164 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -75.07 -9.29 58.4 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.552 1.524 . . . . 0.0 110.759 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 12.6 mt -135.79 96.19 13.44 Favored Pre-proline 0 N--CA 1.452 -0.332 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -177.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -71.3 82.13 1.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.8 2.333 . . . . 0.0 110.115 -177.209 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 143.99 -17.03 2.16 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.792 1.663 . . . . 0.0 113.353 -174.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -67.89 -25.05 65.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.931 1.865 . . . . 0.0 109.928 174.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.26 -41.87 8.66 Favored Glycine 0 C--O 1.217 -0.927 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -46.31 87.46 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 118.906 1.353 . . . . 0.0 112.158 177.147 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -61.52 -49.93 74.73 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.56 0.744 . . . . 0.0 109.752 175.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.75 -49.97 70.89 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.183 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -56.74 -46.93 81.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 11.4 mt -56.42 -51.47 68.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.001 0.92 . . . . 0.0 111.518 174.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 41.6 t -58.28 -44.31 87.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 119.486 1.039 . . . . 0.0 110.444 178.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -60.9 -45.53 94.24 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.455 1.502 . . . . 0.0 108.924 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 19.7 m -62.01 -42.77 99.52 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.496 1.518 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . 0.51 ' HG ' HD11 ' A' ' 458' ' ' LEU . 81.1 m -64.96 -41.79 95.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 120.756 1.616 . . . . 0.0 110.816 178.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.3 -22.07 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.504 1.122 . . . . 0.0 111.978 174.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 19.8 t -88.65 -39.08 14.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.671 1.188 . . . . 0.0 111.286 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -76.19 105.51 2.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.249 1.02 . . . . 0.0 109.775 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.83 117.57 5.18 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 121.865 1.71 . . . . 0.0 110.513 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 71.05 35.12 64.6 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 177.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 21.4 tp -56.83 158.28 4.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.612 0.765 . . . . 0.0 111.17 175.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.62 168.92 18.37 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -50.48 -51.21 49.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.204 1.402 . . . . 0.0 110.686 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.79 -39.48 33.77 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -176.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -64.67 -25.45 67.95 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.307 0.643 . . . . 0.0 111.48 -177.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 57.3 tp -59.93 -52.52 65.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.562 0.745 . . . . 0.0 109.408 174.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 8.9 mp -62.95 -37.49 87.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.148 179.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.32 -39.1 85.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.11 0.564 . . . . 0.0 111.232 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -64.69 -20.52 66.36 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -114.9 16.47 17.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.444 1.497 . . . . 0.0 109.817 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -52.37 125.62 16.65 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.123 -1.61 . . . . 0.0 110.072 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 80.36 11.34 84.33 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.883 -0.954 . . . . 0.0 113.916 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' THR . . . . . 0.417 HG21 ' H ' ' A' ' 512' ' ' ASN . 35.2 m -93.27 147.4 22.95 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 120.133 1.966 . . . . 0.0 108.448 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.09 -15.63 46.54 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 177.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . 0.417 ' H ' HG21 ' A' ' 510' ' ' THR . 0.1 OUTLIER -92.3 -17.85 24.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.694 1.598 . . . . 0.0 112.403 173.921 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.33 -38.27 68.51 Favored 'General case' 0 C--O 1.198 -1.654 0 C-N-CA 124.581 1.152 . . . . 0.0 110.466 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.14 -46.24 65.32 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 122.755 0.422 . . . . 0.0 110.618 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 97.7 m -61.58 -48.67 79.91 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.015 -1.053 . . . . 0.0 109.949 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 94.9 mt -61.81 -40.66 96.02 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.678 0.791 . . . . 0.0 111.864 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -62.8 -45.83 90.82 Favored 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.805 1.642 . . . . 0.0 108.532 178.143 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -63.32 -30.06 71.26 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.234 -0.889 . . . . 0.0 112.066 174.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 22.3 mt -85.37 -14.45 46.32 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.857 1.208 . . . . 0.0 113.237 176.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.8 t -75.01 -54.83 6.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.654 1.182 . . . . 0.0 108.175 177.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -74.53 13.01 0.67 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.068 2.147 . . . . 0.0 113.589 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -82.81 97.28 8.54 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.824 1.25 . . . . 0.0 113.265 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.0 14.11 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 129.134 2.973 . . . . 0.0 112.526 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -61.13 -25.07 66.73 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.425 1.89 . . . . 0.0 111.375 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -110.73 -48.55 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 127.683 2.393 . . . . 0.0 111.358 176.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 52.31 20.51 1.41 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.119 2.568 . . . . 0.0 115.629 177.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -137.74 172.14 13.39 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.728 -1.232 . . . . 0.0 110.492 -173.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -124.29 -16.49 6.4 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.076 1.35 . . . . 0.0 113.844 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.36 -53.36 4.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.849 2.46 . . . . 0.0 107.756 175.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.34 -25.91 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.383 175.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.92 -59.52 4.05 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.962 1.305 . . . . 0.0 111.185 174.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.6 -44.08 80.77 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.05 0.841 . . . . 0.0 111.04 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -51.67 64.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.643 0.777 . . . . 0.0 109.793 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 53.1 m -66.36 -30.49 70.9 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.151 1.38 . . . . 0.0 110.825 -176.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 81.2 t80 -64.54 -56.18 15.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 176.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 98.2 m -59.46 -38.03 79.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.666 0.786 . . . . 0.0 111.258 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.11 -47.55 79.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.495 1.141 . . . . 0.0 111.237 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 24.5 t -65.62 -43.35 89.8 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 120.788 -1.195 . . . . 0.0 111.581 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.8 -50.28 63.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 118.989 0.813 . . . . 0.0 109.906 174.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -57.27 -43.97 83.55 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 123.346 0.658 . . . . 0.0 109.794 175.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.73 -40.61 88.44 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 119.312 0.96 . . . . 0.0 111.873 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.72 -51.89 67.69 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.33 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 7.0 m-85 -64.73 -41.97 95.56 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.867 0.867 . . . . 0.0 111.316 -177.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.6 -49.73 74.04 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.344 2.258 . . . . 0.0 109.136 174.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 17.4 t -56.78 -43.79 81.21 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 123.471 0.708 . . . . 0.0 110.591 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.45 -37.25 80.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.768 1.167 . . . . 0.0 110.358 -177.076 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 72.0 mt -70.27 -41.6 73.23 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.673 -0.68 . . . . 0.0 109.901 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.36 -50.82 68.43 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.347 1.459 . . . . 0.0 109.546 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.47 -47.14 73.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.072 0.949 . . . . 0.0 109.308 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -57.95 -44.84 87.22 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.303 0.956 . . . . 0.0 110.909 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -52.82 36.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.251 1.02 . . . . 0.0 109.87 173.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.08 -43.18 96.19 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.848 0.749 . . . . 0.0 110.53 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . 0.457 ' CG ' HH22 ' A' ' 557' ' ' ARG . 1.5 tp10 -59.98 -39.13 84.65 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.802 1.241 . . . . 0.0 110.096 -175.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.63 -53.28 56.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.561 1.544 . . . . 0.0 109.379 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 42.8 mm -60.58 -36.33 69.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-N 119.393 0.997 . . . . 0.0 110.93 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.0 -21.5 66.52 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.217 -1.552 . . . . 0.0 111.724 176.58 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . 0.457 HH22 ' CG ' ' A' ' 553' ' ' GLU . 4.2 ttm105 -84.57 -10.67 57.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 115.632 -2.128 . . . . 0.0 111.377 173.772 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -64.36 0.95 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 121.093 1.769 . . . . 0.0 110.257 174.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -71.56 3.23 4.11 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.816 1.247 . . . . 0.0 114.144 -173.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 46.8 p -118.72 -51.11 2.38 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.612 1.165 . . . . 0.0 111.343 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -50.56 2.83 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.734 1.214 . . . . 0.0 111.163 -174.434 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 123.5 131.91 3.86 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 126.29 1.9 . . . . 0.0 109.712 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.8 mt -86.56 137.85 32.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 6.3 t -68.86 167.3 15.9 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.224 1.012 . . . . 0.0 110.408 173.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -42.75 84.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.508 175.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -48.77 58.36 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 124.591 1.156 . . . . 0.0 109.823 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -60.7 -38.82 86.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.409 0.684 . . . . 0.0 110.858 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -62.48 -35.6 79.84 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.38 -0.825 . . . . 0.0 109.629 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 6.2 mp -71.96 -43.15 65.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 117.14 -1.41 . . . . 0.0 110.881 173.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -51.99 -37.49 53.36 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.469 1.031 . . . . 0.0 109.522 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.8 mt -62.9 -42.12 99.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 116.608 -1.663 . . . . 0.0 113.483 174.405 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -58.39 -44.96 89.17 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 121.37 1.896 . . . . 0.0 108.482 175.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -48.61 76.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -175.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.2 -42.11 98.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.74 1.216 . . . . 0.0 111.373 177.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -57.35 -45.36 84.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.365 0.666 . . . . 0.0 109.333 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -73.25 -27.45 61.59 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.135 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.09 -36.86 80.48 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.667 1.587 . . . . 0.0 109.564 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.4 mt -81.57 -25.96 35.37 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.799 0.84 . . . . 0.0 111.805 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 44.04 45.14 6.57 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.786 2.034 . . . . 0.0 113.327 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -147.04 179.58 7.51 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.075 -1.015 . . . . 0.0 110.235 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 118.429 -0.796 . . . . 0.0 110.953 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.6 tttt . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.9 163.67 34.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 120.181 1.355 . . . . 0.0 108.503 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -152.07 -176.16 5.54 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.315 178.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 55.2 m -146.27 -85.95 0.11 Allowed 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 173.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.9 ptt? -165.74 -44.05 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -178.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.96 -21.98 65.95 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 116.907 -1.52 . . . . 0.0 111.046 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -53.1 -48.74 52.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 C-N-CA 126.181 1.792 . . . . 0.0 109.453 173.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 32.6 mt -53.5 -45.08 69.53 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 118.657 0.662 . . . . 0.0 109.906 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 95.7 mt -72.18 -51.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.341 176.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -65.04 -32.43 84.13 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-N 121.431 1.923 . . . . 0.0 113.373 -173.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 71.4 mt -70.39 -40.22 74.07 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.17 174.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -34.44 77.82 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.932 1.293 . . . . 0.0 109.99 174.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 16.4 t -60.65 -58.65 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -71.77 -22.32 61.61 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.19 -177.007 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -135.44 77.53 53.13 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 127.051 2.141 . . . . 0.0 108.455 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.08 -13.67 36.81 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 121.311 1.341 . . . . 0.0 112.485 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -70.49 -19.79 62.9 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.725 0.81 . . . . 0.0 111.323 173.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 36.0 mt -62.96 -15.66 56.69 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.399 1.454 . . . . 0.0 110.571 175.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.65 -30.97 72.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 119.36 0.982 . . . . 0.0 110.832 174.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.1 m -74.84 -19.48 60.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.997 0.817 . . . . 0.0 110.792 174.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 25.1 mt -91.0 -22.56 20.74 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 120.865 -1.147 . . . . 0.0 110.798 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -70.06 156.34 91.96 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 118.947 0.794 . . . . 0.0 110.244 179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 23.0 Cg_endo -74.74 174.01 13.42 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 124.475 3.45 . . . . 0.0 112.448 176.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -76.71 12.04 1.77 Allowed 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 121.698 1.599 . . . . 0.0 113.519 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 10.2 mp 64.54 46.86 3.11 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.766 2.426 . . . . 0.0 112.428 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.03 -42.12 60.78 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -105.68 17.76 23.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.765 1.226 . . . . 0.0 111.053 -175.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -97.64 -77.56 0.5 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -173.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 31.3 t0 64.41 141.42 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.258 2.223 . . . . 0.0 112.781 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -68.44 -20.06 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 120.997 -1.065 . . . . 0.0 109.547 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -62.31 -45.61 92.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.93 1.292 . . . . 0.0 110.285 173.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -80.62 -35.74 33.6 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 121.661 -0.649 . . . . 0.0 110.124 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -121.37 103.58 41.45 Favored Pre-proline 0 CA--C 1.534 0.344 0 C-N-CA 124.032 0.933 . . . . 0.0 108.876 -176.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.11 -20.45 33.19 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.544 1.496 . . . . 0.0 112.356 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.9 -8.9 61.47 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.703 -1.054 . . . . 0.0 112.742 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -32.33 71.05 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 116.256 -1.831 . . . . 0.0 109.721 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.46 -48.73 16.36 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.572 1.533 . . . . 0.0 111.238 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.68 -44.89 95.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.836 -0.803 . . . . 0.0 111.692 175.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 57.4 t80 -64.37 -48.79 74.15 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 119.115 0.871 . . . . 0.0 111.718 179.544 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.23 -53.63 51.0 Favored 'General case' 0 CA--C 1.504 -0.811 0 C-N-CA 125.272 1.429 . . . . 0.0 108.186 175.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.07 -41.58 92.72 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.629 1.104 . . . . 0.0 110.872 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.4 mt -56.42 -56.86 15.88 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.136 0.974 . . . . 0.0 110.158 173.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 53.5 t -58.7 -46.34 90.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.428 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -55.97 -46.45 78.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 125.779 1.632 . . . . 0.0 108.755 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 24.0 m -62.15 -44.13 97.3 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 125.81 1.644 . . . . 0.0 111.072 174.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.19 -37.12 86.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.069 0.849 . . . . 0.0 110.594 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -28.42 70.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.003 1.321 . . . . 0.0 109.679 174.329 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.67 -57.09 4.0 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.26 -0.9 . . . . 0.0 110.329 174.585 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -61.03 108.59 1.55 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.604 1.162 . . . . 0.0 110.241 -175.058 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -73.81 141.02 29.83 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 122.238 1.959 . . . . 0.0 109.398 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 50.24 33.58 23.59 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.097 1.332 . . . . 0.0 111.873 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 36.8 tp -54.03 156.3 3.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.976 1.37 . . . . 0.0 109.651 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -135.05 163.77 29.13 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.178 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 8.3 m -50.84 -46.97 60.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 125.593 1.557 . . . . 0.0 110.468 174.008 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.93 -41.6 27.38 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 28.1 tp60 -62.33 -24.67 67.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.609 -0.936 . . . . 0.0 110.459 -178.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 40.9 tp -68.37 -45.36 72.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 119.606 1.094 . . . . 0.0 108.902 174.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.66 -38.62 85.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.608 -0.711 . . . . 0.0 111.012 175.677 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.26 -39.35 82.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.126 0.571 . . . . 0.0 111.355 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -66.98 -20.46 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 120.539 -1.35 . . . . 0.0 112.144 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -111.35 15.05 21.55 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.476 1.11 . . . . 0.0 109.931 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -54.63 128.59 33.09 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 119.985 -1.697 . . . . 0.0 110.173 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 76.7 15.42 81.6 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.272 -0.738 . . . . 0.0 114.108 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 53.7 m -93.98 145.95 24.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.885 1.343 . . . . 0.0 110.844 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -59.41 -22.87 62.06 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.025 -1.047 . . . . 0.0 111.427 174.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -92.63 -13.95 28.83 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 123.786 0.835 . . . . 0.0 112.533 178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.29 -43.23 74.58 Favored 'General case' 0 C--O 1.209 -1.028 0 O-C-N 123.558 0.536 . . . . 0.0 109.735 173.55 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.46 -43.51 75.56 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 112.624 177.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 87.3 m -63.24 -50.06 71.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.376 -0.827 . . . . 0.0 109.141 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 48.7 mt -58.74 -42.15 88.11 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.565 0.746 . . . . 0.0 112.399 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.74 -42.74 81.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.304 1.842 . . . . 0.0 108.608 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -59.15 -30.68 68.33 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.515 -0.755 . . . . 0.0 111.01 173.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 56.3 mt -89.29 -3.86 58.35 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.19 0.905 . . . . 0.0 111.913 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.0 t -79.1 -50.48 10.97 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.117 1.367 . . . . 0.0 109.396 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.57 9.77 8.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.408 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.2 t90 -59.97 112.67 1.96 Allowed 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 125.556 1.542 . . . . 0.0 115.01 -173.321 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.96 -29.22 49.69 Favored 'General case' 0 C--N 1.326 -0.432 1 C-N-CA 131.76 4.024 . . . . 0.0 114.389 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -53.81 -27.31 28.57 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.224 1.81 . . . . 0.0 112.786 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -123.53 -66.88 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 C-N-CA 124.673 1.189 . . . . 0.0 110.472 -179.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.23 42.32 13.29 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.243 1.417 . . . . 0.0 114.005 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.58 172.13 13.24 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.856 -1.152 . . . . 0.0 111.4 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.44 -27.96 3.39 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.938 2.095 . . . . 0.0 111.906 175.32 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -80.9 -54.48 5.55 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.413 1.085 . . . . 0.0 108.513 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.84 -15.0 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 124.721 1.208 . . . . 0.0 109.598 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -61.41 -60.95 2.93 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 119.969 1.259 . . . . 0.0 110.746 173.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -55.96 -40.72 73.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.912 0.778 . . . . 0.0 111.31 -177.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -53.1 54.52 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.194 -0.316 . . . . 0.0 111.541 177.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 86.4 m -63.78 -27.39 69.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.184 0.993 . . . . 0.0 110.758 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -67.72 -53.25 28.97 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 120.173 1.351 . . . . 0.0 107.684 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 72.9 m -66.22 -39.09 89.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.291 -0.862 . . . . 0.0 111.213 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.38 -44.33 97.35 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.612 1.097 . . . . 0.0 109.614 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 t -61.22 -55.11 35.82 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 120.954 -1.091 . . . . 0.0 110.604 176.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.12 -44.34 79.04 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 125.009 1.323 . . . . 0.0 108.831 -178.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.01 -44.0 98.06 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.353 0.979 . . . . 0.0 110.428 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -67.55 -40.75 84.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.891 0.769 . . . . 0.0 111.539 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.2 mmt -59.44 -53.1 62.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 121.14 -0.975 . . . . 0.0 109.504 173.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.69 -45.09 93.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.545 0.738 . . . . 0.0 111.428 -179.437 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -57.67 -46.76 83.83 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.051 1.34 . . . . 0.0 109.807 177.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.7 t -56.15 -39.12 71.8 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.484 0.714 . . . . 0.0 110.893 174.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 38.2 mt -73.89 -35.04 64.65 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 120.675 -1.266 . . . . 0.0 110.819 -178.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.8 -43.6 79.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.661 1.185 . . . . 0.0 108.737 175.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . 0.475 ' OE2' ' HE2' ' A' ' 581' ' ' LYS . 6.6 tt0 -59.49 -53.58 56.53 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.554 1.142 . . . . 0.0 110.571 174.103 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 56.5 mt -57.41 -43.21 83.56 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.815 -0.553 . . . . 0.0 110.325 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -59.29 -44.06 92.52 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 117.231 -1.366 . . . . 0.0 109.464 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.38 -50.74 66.8 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 119.329 0.968 . . . . 0.0 110.209 176.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -44.92 89.14 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.675 -0.678 . . . . 0.0 110.039 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -41.42 96.19 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.159 0.984 . . . . 0.0 109.769 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 10.7 mt -60.85 -52.46 64.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.602 1.561 . . . . 0.0 108.909 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.3 mm -61.62 -36.27 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-N 119.967 1.258 . . . . 0.0 111.162 174.081 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.47 -24.88 66.88 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.277 -1.514 . . . . 0.0 110.745 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -84.65 -7.03 59.38 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 115.808 -2.044 . . . . 0.0 111.659 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.13 -60.33 2.56 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 122.54 2.427 . . . . 0.0 106.525 173.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -76.08 -4.4 41.23 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.301 -1.499 . . . . 0.0 113.99 -173.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -114.88 -63.67 1.42 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 121.171 1.805 . . . . 0.0 109.884 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -74.89 -44.51 48.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.538 1.135 . . . . 0.0 111.499 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 111.99 3.98 26.17 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 116.339 -2.367 . . . . 0.0 113.65 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 4.1 mt 41.17 -159.05 0.01 OUTLIER 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 127.866 2.467 . . . . 0.0 110.915 -173.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 29.6 t -139.33 160.23 40.32 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -40.17 74.07 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.3 -52.09 13.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.884 0.874 . . . . 0.0 109.603 -178.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.96 -36.54 75.0 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.297 0.953 . . . . 0.0 111.325 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 17.8 ttt85 -61.83 -32.58 72.91 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.128 -1.608 . . . . 0.0 111.138 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 85.9 mt -80.71 -33.44 35.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.954 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -53.36 -46.1 69.44 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 5.5 mt -56.45 -40.5 74.92 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 116.868 -1.539 . . . . 0.0 113.605 174.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.33 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 122.405 2.366 . . . . 0.0 109.071 175.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 2.8 m -62.31 -47.61 83.5 Favored 'General case' 0 CA--C 1.528 0.112 0 O-C-N 125.114 1.509 . . . . 0.0 107.215 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.28 87.24 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.712 -1.242 . . . . 0.0 111.001 177.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -65.08 -37.14 86.55 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.041 -1.037 . . . . 0.0 111.184 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -75.53 -25.38 57.14 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.679 -1.153 . . . . 0.0 110.364 175.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -45.58 77.6 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.416 1.007 . . . . 0.0 108.339 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 4.9 mt -80.46 -7.53 59.19 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.782 1.233 . . . . 0.0 112.844 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 31.23 50.07 0.11 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 128.271 2.628 . . . . 0.0 115.563 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.44 78.37 0.29 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.687 1.995 . . . . 0.0 109.888 -175.296 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . 0.475 ' HE2' ' OE2' ' A' ' 548' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.401 0 C-N-CA 127.916 2.486 . . . . 0.0 113.945 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.8 mptt . . . . . 0 C--O 1.224 -0.277 0 CA-C-O 120.908 0.385 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 27.8 mtt-85 -99.17 -68.51 0.8 Allowed 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 124.162 0.985 . . . . 0.0 108.863 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 1.1 m -159.9 146.0 15.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 -176.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.7 t -152.8 39.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 123.764 0.825 . . . . 0.0 109.582 175.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 79.6 -38.89 0.19 Allowed 'General case' 0 N--CA 1.481 1.105 0 O-C-N 121.174 -0.954 . . . . 0.0 110.841 177.502 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 71.2 mtt-85 -56.76 -27.64 59.81 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 115.513 -2.184 . . . . 0.0 109.978 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.8 mm -64.77 -53.22 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 119.858 1.208 . . . . 0.0 108.861 174.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . 0.46 HD21 ' CE1' ' A' ' 535' ' ' PHE . 11.6 mt -59.44 -46.8 87.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.394 0.997 . . . . 0.0 110.147 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 15.7 mt -68.29 -57.87 7.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.999 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.973 178.351 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . 0.462 ' HA3' ' CE3' ' A' ' 522' ' ' TRP . . . -52.62 -42.52 58.4 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 126.285 1.898 . . . . 0.0 111.577 -178.318 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 97.4 mt -68.26 -44.25 76.0 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-O 117.693 -1.146 . . . . 0.0 109.686 173.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -59.78 -30.78 69.12 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.626 1.103 . . . . 0.0 110.893 175.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.11 -49.94 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -74.96 -18.89 60.31 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.484 0.659 . . . . 0.0 111.922 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 7.6 t-20 -137.56 83.82 24.43 Favored Pre-proline 0 N--CA 1.44 -0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 107.862 -173.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -68.51 -19.86 42.15 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.596 1.531 . . . . 0.0 111.852 178.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.03 -28.54 70.16 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.214 173.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 15.8 mt -59.87 -16.98 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.609 -1.307 . . . . 0.0 111.766 -179.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -60.08 -27.47 67.01 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.85 -0.531 . . . . 0.0 111.221 173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 -16.51 49.56 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 120.139 -1.601 . . . . 0.0 112.847 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 8.3 mt -85.16 -18.57 33.73 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.777 1.231 . . . . 0.0 108.827 175.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . 0.405 HG11 ' CG1' ' A' ' 489' ' ' VAL . 0.5 OUTLIER -66.87 148.63 98.78 Favored Pre-proline 0 N--CA 1.439 -0.99 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.782 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 13.6 Cg_endo -73.95 179.43 5.72 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 122.099 1.866 . . . . 0.0 111.04 178.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -79.72 14.45 1.85 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.826 3.018 . . . . 0.0 112.208 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER 69.09 70.35 0.27 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 126.375 1.87 . . . . 0.0 107.693 174.412 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -105.39 -57.79 1.99 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.062 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -80.79 11.93 3.56 Favored 'General case' 0 CA--C 1.498 -1.046 0 C-N-CA 123.565 0.746 . . . . 0.0 112.491 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 36.8 mt -119.59 -49.99 2.33 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.915 0.886 . . . . 0.0 111.389 -173.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.4 t70 46.39 25.45 0.38 Allowed 'General case' 0 C--N 1.363 1.184 0 C-N-CA 128.6 2.76 . . . . 0.0 111.165 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 40.9 26.39 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 129.378 3.071 . . . . 0.0 112.874 -175.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -135.1 15.6 3.51 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 131.377 3.871 . . . . 0.0 111.607 -177.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 5.4 mmpt? -97.49 -42.76 7.56 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.591 174.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -121.98 145.47 43.78 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.045 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -72.5 5.67 2.7 Favored 'Trans proline' 0 N--CA 1.477 0.544 0 C-N-CA 123.314 2.676 . . . . 0.0 114.258 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -125.32 -11.28 4.25 Favored Glycine 0 N--CA 1.44 -1.074 0 CA-C-O 116.752 -2.138 . . . . 0.0 109.593 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.35 -45.08 69.01 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 119.905 1.852 . . . . 0.0 107.565 -178.469 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -50.75 -49.5 40.7 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 176.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 30.2 tp -61.38 -53.19 59.81 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 118.281 1.041 . . . . 0.0 111.085 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -52.41 -48.08 65.92 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 123.534 0.734 . . . . 0.0 110.865 175.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -59.67 -50.84 72.29 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.74 -44.56 96.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.818 0.847 . . . . 0.0 111.324 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 4.7 mt -59.17 -45.56 90.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.232 1.013 . . . . 0.0 109.755 177.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . 0.405 ' CG1' HG11 ' A' ' 468' ' ' VAL . 72.8 t -65.69 -45.05 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.517 176.216 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -54.19 -42.85 70.18 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.379 1.071 . . . . 0.0 109.776 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.3 m -71.65 -43.26 66.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.173 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 57.4 m -55.85 -48.41 75.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.776 1.171 . . . . 0.0 109.583 177.306 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.1 -21.27 58.99 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 125.85 1.66 . . . . 0.0 110.745 177.276 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.48 5.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.075 0.95 . . . . 0.0 109.791 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -63.12 104.64 0.52 Allowed Pre-proline 0 N--CA 1.468 0.452 0 C-N-CA 125.837 1.655 . . . . 0.0 110.496 -176.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -70.5 133.21 23.71 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 121.328 1.352 . . . . 0.0 110.485 -178.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.79 37.91 52.8 Favored Glycine 0 N--CA 1.469 0.853 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 43.3 tp -57.82 156.09 9.37 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.393 0.616 . . . . 0.0 109.935 -179.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.48 168.36 19.08 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -174.417 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.0 m -58.18 -38.03 75.89 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.55 0.74 . . . . 0.0 110.041 173.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.18 -41.38 8.04 Favored Glycine 0 C--N 1.339 0.724 0 O-C-N 120.798 -1.189 . . . . 0.0 110.431 -177.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 39.3 tp60 -60.57 -27.87 68.02 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 117.679 -1.153 . . . . 0.0 109.691 179.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 30.2 tp -64.39 -53.81 42.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 119.601 1.091 . . . . 0.0 109.646 177.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -61.28 -34.58 75.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.457 179.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -71.94 -35.46 69.63 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.327 0.651 . . . . 0.0 111.946 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -72.55 -5.21 35.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.089 2.156 . . . . 0.0 111.676 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . 0.428 ' CD2' HD12 ' A' ' 516' ' ' LEU . 44.0 m-85 -122.83 18.29 10.21 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.864 1.666 . . . . 0.0 109.774 174.058 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.67 134.51 56.88 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 119.525 -1.985 . . . . 0.0 109.292 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 70.53 21.44 77.63 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.023 176.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 95.3 m -94.43 144.78 25.27 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.341 1.571 . . . . 0.0 108.697 178.246 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -63.02 -17.27 62.03 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.469 -0.769 . . . . 0.0 109.11 173.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 42.8 m-80 -96.95 -20.59 17.99 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 119.318 -2.114 . . . . 0.0 111.246 176.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -45.18 -39.78 6.54 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 124.889 1.368 . . . . 0.0 109.278 178.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.48 20.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 111.201 177.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 98.4 m -57.86 -41.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.354 0 O-C-N 120.675 -1.265 . . . . 0.0 110.713 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . 0.428 HD12 ' CD2' ' A' ' 507' ' ' TYR . 28.8 mt -64.96 -31.62 72.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.808 175.611 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.94 -45.45 57.97 Favored 'General case' 0 CA--C 1.506 -0.75 0 C-N-CA 125.95 1.7 . . . . 0.0 109.284 -176.174 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -35.73 80.91 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 119.639 -0.825 . . . . 0.0 109.72 175.988 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 48.0 mt -77.69 -13.61 59.85 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 119.079 -0.486 . . . . 0.0 111.86 177.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.2 t -76.48 -60.82 2.18 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 126.012 1.725 . . . . 0.0 108.215 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -2.52 14.32 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 177.362 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . 0.474 ' CE3' ' CD1' ' A' ' 525' ' ' ILE . 1.3 t90 -49.49 115.75 1.47 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 123.456 0.703 . . . . 0.0 109.962 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.09 2.76 35.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.925 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -54.87 -23.83 20.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 118.776 0.717 . . . . 0.0 112.411 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . 0.474 ' CD1' ' CE3' ' A' ' 522' ' ' TRP . 0.0 OUTLIER -109.68 -53.73 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 127.469 2.308 . . . . 0.0 109.493 178.878 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.28 47.61 5.63 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.627 1.571 . . . . 0.0 111.159 -178.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -161.11 151.05 17.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -174.639 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 -33.44 7.2 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.968 1.707 . . . . 0.0 113.021 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.96 -60.48 2.34 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 126.492 1.917 . . . . 0.0 109.456 177.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 87.2 mt -55.26 -29.39 23.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 117.071 -1.443 . . . . 0.0 107.173 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -46.9 -55.07 8.65 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.256 1.389 . . . . 0.0 111.514 175.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -56.4 -43.99 79.84 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.193 0.906 . . . . 0.0 110.23 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -48.35 79.43 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.372 177.48 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 40.2 m -64.14 -31.15 72.24 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.358 1.863 . . . . 0.0 108.281 -177.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . 0.46 ' CE1' HD21 ' A' ' 454' ' ' LEU . 41.5 t80 -69.25 -59.28 3.12 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 124.853 1.261 . . . . 0.0 109.807 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -58.38 -40.16 81.57 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.493 178.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.57 -45.19 92.58 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 118.577 0.626 . . . . 0.0 112.151 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.9 t -67.48 -50.95 56.72 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 117.6 -1.191 . . . . 0.0 110.385 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -44.79 72.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.981 1.712 . . . . 0.0 108.567 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.88 -38.69 92.01 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 124.721 1.263 . . . . 0.0 110.532 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -72.42 -39.41 67.9 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 119.146 0.885 . . . . 0.0 109.051 -176.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -59.85 4.43 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 126.198 1.799 . . . . 0.0 107.462 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -54.54 -46.47 73.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 125.014 1.446 . . . . 0.0 110.055 -179.25 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -56.97 -48.89 77.32 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.078 0.951 . . . . 0.0 109.254 178.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -47.59 67.22 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 20.4 mt -63.8 -45.77 88.16 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.219 -0.3 . . . . 0.0 110.359 -179.153 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -37.02 73.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.495 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -63.06 -50.15 71.71 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.89 1.276 . . . . 0.0 109.519 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 1.4 mt -60.77 -48.45 81.75 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -57.13 -52.99 63.08 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.731 179.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -50.19 -54.05 23.62 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.725 1.21 . . . . 0.0 108.748 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -58.3 -39.26 78.86 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-O 117.832 -1.08 . . . . 0.0 109.832 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.43 -39.1 75.48 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 120.031 1.287 . . . . 0.0 112.629 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -65.38 -51.9 57.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 176.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 28.2 mm -65.65 -36.28 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 123.528 1.632 . . . . 0.0 113.115 -179.428 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -59.84 -28.58 67.61 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 120.519 -1.363 . . . . 0.0 109.973 174.386 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.01 14.0 33.37 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 125.047 1.339 . . . . 0.0 110.983 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 19.1 tt0 -100.64 -41.68 6.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 118.987 0.812 . . . . 0.0 109.182 176.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -79.48 -14.76 58.68 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.316 -0.865 . . . . 0.0 111.169 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 72.3 p -101.11 -88.51 0.37 Allowed 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -174.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -51.27 48.51 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 125.184 1.552 . . . . 0.0 108.312 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 89.76 79.49 1.34 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.609 1.576 . . . . 0.0 109.243 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -41.21 159.34 0.02 OUTLIER 'General case' 0 C--N 1.346 0.431 0 C-N-CA 127.012 2.125 . . . . 0.0 110.867 172.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.1 p -59.4 163.02 4.27 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 122.439 1.114 . . . . 0.0 109.776 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -54.96 -42.16 72.02 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 110.742 173.727 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -62.59 -46.74 86.94 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.365 1.066 . . . . 0.0 110.102 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -64.26 -34.21 77.59 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.178 0.513 . . . . 0.0 111.051 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -37.96 88.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 121.165 -0.96 . . . . 0.0 110.64 176.13 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -67.48 -44.34 78.77 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 117.657 -1.163 . . . . 0.0 108.905 178.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.72 -37.11 58.61 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 118.768 0.713 . . . . 0.0 110.52 179.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 2.1 mt -60.51 -51.54 69.0 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 115.57 -2.157 . . . . 0.0 112.154 174.414 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -45.97 -49.94 15.33 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 121.621 2.009 . . . . 0.0 109.536 174.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.95 -32.63 74.44 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.192 1.397 . . . . 0.0 110.628 -177.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -76.43 -43.05 41.88 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.532 1.133 . . . . 0.0 109.255 174.745 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.46 -46.53 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 119.253 -2.155 . . . . 0.0 108.6 -176.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.99 71.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.808 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -44.08 81.17 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.093 1.757 . . . . 0.0 107.89 -175.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 13.0 mt -82.18 -25.52 34.21 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.545 178.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 67.25 -53.05 0.48 Allowed 'General case' 0 C--O 1.238 0.487 0 C-N-CA 129.38 3.072 . . . . 0.0 112.009 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.77 110.53 1.94 Allowed 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.982 1.313 . . . . 0.0 108.662 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 115.342 -2.266 . . . . 0.0 113.879 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 105.91 166.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 134.755 5.222 . . . . 0.0 102.908 -172.644 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . 0.251 17.8 m 53.01 136.55 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.675 2.39 . . . . 0.0 114.921 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' THR . . . . . 0.504 HG22 ' H ' ' A' ' 452' ' ' ARG . 86.3 m -152.54 152.74 32.24 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 118.54 -2.6 . . . . 0.0 108.327 -178.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -54.02 -25.83 23.21 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.074 . . . . 0.0 113.175 174.248 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . 0.504 ' H ' HG22 ' A' ' 450' ' ' THR . 5.5 mpt_? -65.76 -39.17 90.77 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.762 -1.589 . . . . 0.0 111.692 173.905 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.8 mm -61.27 -53.18 52.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . 0.529 ' HG ' ' HG ' ' A' ' 538' ' ' SER . 13.6 mt -60.07 -45.75 91.86 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.458 1.026 . . . . 0.0 111.282 -175.132 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.55 -54.06 29.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.74 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -60.8 -32.1 78.08 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 119.741 1.155 . . . . 0.0 112.538 -175.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.29 -47.83 63.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 117.677 0.739 . . . . 0.0 109.392 173.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -59.9 -28.05 67.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.489 0.715 . . . . 0.0 111.001 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 40.0 t -68.33 -57.23 9.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.197 0 O-C-N 121.047 -1.033 . . . . 0.0 108.959 173.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.56 -18.48 61.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.735 -0.603 . . . . 0.0 111.665 -174.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -142.53 83.41 11.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 126.483 1.913 . . . . 0.0 109.623 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -70.79 -13.63 32.24 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 121.264 1.309 . . . . 0.0 112.975 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -68.51 -14.26 62.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.755 1.161 . . . . 0.0 110.464 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 67.0 mt -63.4 -13.6 41.45 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.157 -0.965 . . . . 0.0 109.584 173.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.41 -24.31 67.59 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.121 -0.987 . . . . 0.0 110.929 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.8 m -83.64 -13.99 52.95 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.234 0.924 . . . . 0.0 110.908 173.527 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.7 mt -94.8 -14.22 24.88 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.333 1.053 . . . . 0.0 112.047 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 9.5 p -91.21 142.83 27.55 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 120.411 1.459 . . . . 0.0 108.869 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -68.61 170.67 14.63 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.05 13.07 0.15 Allowed 'Trans proline' 0 CA--C 1.554 1.512 0 C-N-CA 124.924 3.749 . . . . 0.0 115.213 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 1.5 mm? 72.08 46.01 0.36 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.668 2.787 . . . . 0.0 113.359 173.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.39 -83.32 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.714 2.005 . . . . 0.0 111.694 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.13 -2.38 12.82 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 119.882 -1.761 . . . . 0.0 113.48 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -74.8 -76.62 0.14 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.256 1.823 . . . . 0.0 108.214 -175.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 57.1 t0 62.25 131.71 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 124.139 1.923 . . . . 0.0 113.042 -177.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.47 -20.32 65.48 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.995 1.718 . . . . 0.0 110.394 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -73.08 -33.5 65.66 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.731 1.212 . . . . 0.0 110.456 174.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -80.67 -39.35 27.42 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.418 1.463 . . . . 0.0 111.812 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -119.09 118.22 32.94 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.96 2.74 2.84 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.136 1.891 . . . . 0.0 113.576 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -114.9 0.63 22.94 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 118.064 -1.409 . . . . 0.0 111.892 174.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.48 -47.91 79.84 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 119.158 1.479 . . . . 0.0 108.138 176.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -51.53 -49.37 46.27 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 118.765 0.711 . . . . 0.0 112.116 -176.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.43 -47.29 86.72 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.695 -0.886 . . . . 0.0 110.732 177.863 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -65.1 -39.55 93.31 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.249 0.62 . . . . 0.0 111.214 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -60.75 -53.22 60.05 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 126.544 1.938 . . . . 0.0 108.378 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -58.45 -40.99 84.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.857 0.723 . . . . 0.0 110.04 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.14 -57.5 11.9 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.99 0.516 . . . . 0.0 111.704 174.337 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 72.8 t -60.09 -43.8 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 123.859 0.864 . . . . 0.0 110.205 -179.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -57.59 -49.47 76.3 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.321 1.848 . . . . 0.0 109.245 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 96.7 m -58.95 -42.34 89.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.861 1.264 . . . . 0.0 110.758 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.92 -45.0 87.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.524 0.602 . . . . 0.0 109.802 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.89 -23.01 67.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.912 0.885 . . . . 0.0 112.226 174.305 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 6.1 t -86.28 -11.63 51.73 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.247 1.819 . . . . 0.0 113.45 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -133.22 75.47 70.84 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.19 1.796 . . . . 0.0 108.6 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.69 125.27 14.03 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.643 1.562 . . . . 0.0 109.586 -178.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 93.77 9.44 59.84 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.169 -175.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 1.7 tt -62.44 155.14 26.24 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.842 1.321 . . . . 0.0 108.24 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' THR . . . . . 0.433 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.1 p -127.21 169.8 13.09 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 123.85 0.86 . . . . 0.0 110.003 -173.937 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -50.01 -51.77 39.3 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.323 1.449 . . . . 0.0 109.962 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.22 -38.71 28.81 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -175.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.433 ' HB3' ' H ' ' A' ' 499' ' ' THR . 9.0 tp-100 -63.93 -25.77 68.29 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.73 -0.652 . . . . 0.0 110.728 179.024 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 18.7 tp -63.48 -44.4 94.53 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.417 1.008 . . . . 0.0 111.014 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -65.57 -40.8 93.18 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.11 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -63.7 -38.3 90.58 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -70.91 -20.67 62.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.092 -1.005 . . . . 0.0 112.947 -179.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -106.72 11.94 29.73 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.464 1.106 . . . . 0.0 109.682 174.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.0 ttt180 -56.52 128.71 37.5 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 120.33 -1.481 . . . . 0.0 111.005 -174.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.23 5.93 86.81 Favored Glycine 0 CA--C 1.535 1.291 0 CA-C-O 118.495 -1.17 . . . . 0.0 113.502 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 52.6 m -93.93 147.18 23.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 119.59 1.695 . . . . 0.0 107.382 -174.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -59.4 -17.71 32.75 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 120.691 -1.256 . . . . 0.0 113.328 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 7.5 m-80 -92.96 -19.47 21.58 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-O 117.756 -1.116 . . . . 0.0 110.973 177.469 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -46.27 -50.09 16.54 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.64 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.88 -45.3 64.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 0.0 112.178 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 25.8 m -58.42 -49.66 76.48 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.972 -0.537 . . . . 0.0 110.669 173.37 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 35.1 mt -67.6 -35.76 79.59 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 123.788 0.835 . . . . 0.0 111.516 -176.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.13 -47.61 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.911 2.084 . . . . 0.0 107.611 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.26 -29.88 70.11 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 117.509 -1.234 . . . . 0.0 112.213 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 81.8 mt -89.44 -10.86 44.83 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.51 1.05 . . . . 0.0 112.263 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 18.3 t -77.64 -54.08 6.81 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.454 1.502 . . . . 0.0 109.819 174.047 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.78 19.1 1.76 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.751 1.221 . . . . 0.0 112.571 -178.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -74.95 102.23 4.72 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 116.816 2.154 . . . . 0.0 116.816 -172.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -3.74 18.65 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 129.755 3.222 . . . . 0.0 113.693 178.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.91 -20.39 52.96 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.138 -0.976 . . . . 0.0 111.379 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.12 -63.28 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 126.01 1.724 . . . . 0.0 109.701 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 46.27 25.12 0.33 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.807 2.043 . . . . 0.0 115.889 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -126.23 177.11 6.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.036 1.335 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.32 -21.66 2.29 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.32 1.448 . . . . 0.0 112.982 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -88.22 -56.95 3.11 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.751 2.02 . . . . 0.0 108.036 174.403 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 43.1 mt -58.51 -31.37 43.31 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.264 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -51.32 -54.17 28.76 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 118.651 0.66 . . . . 0.0 112.251 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.77 -45.98 84.07 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.312 0.505 . . . . 0.0 109.91 -177.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.15 -44.74 94.74 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.108 0.563 . . . . 0.0 110.972 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 96.8 m -69.1 -30.81 69.18 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.503 176.049 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -62.13 -55.15 31.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 120.879 1.672 . . . . 0.0 108.698 174.404 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.6 m -60.36 -41.41 93.63 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.055 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.97 -47.32 78.01 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.919 0.781 . . . . 0.0 111.929 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' SER . . . . . 0.529 ' HG ' ' HG ' ' A' ' 454' ' ' LEU . 46.5 t -61.21 -50.01 74.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.499 1.52 . . . . 0.0 111.536 177.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.42 -49.48 72.3 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.152 1.381 . . . . 0.0 110.138 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -58.62 -46.08 87.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 118.193 -0.908 . . . . 0.0 109.735 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -62.34 -40.29 95.89 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 119.313 0.961 . . . . 0.0 110.667 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -52.73 64.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -63.22 -45.6 90.9 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.671 0.788 . . . . 0.0 111.296 -177.77 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -52.46 -49.04 65.44 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.764 2.426 . . . . 0.0 109.477 175.583 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 10.7 t -60.7 -41.36 95.03 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.146 0.579 . . . . 0.0 111.9 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 86.5 mt -67.76 -34.74 77.41 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.681 -1.262 . . . . 0.0 110.788 178.605 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 77.8 mt -70.82 -39.72 72.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.271 1.428 . . . . 0.0 110.551 176.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.06 -48.01 77.89 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.231 1.412 . . . . 0.0 108.865 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.6 -48.03 80.53 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 123.473 0.709 . . . . 0.0 109.575 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -62.26 -42.04 98.98 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.739 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -55.41 -50.08 70.69 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 118.604 -0.713 . . . . 0.0 110.104 173.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.16 90.07 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 119.448 1.022 . . . . 0.0 109.549 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -66.36 -35.89 81.5 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.267 0.556 . . . . 0.0 110.202 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.282 0.2 OUTLIER -77.15 -39.64 48.43 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.332 1.053 . . . . 0.0 111.028 176.991 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.1 mm -66.59 -33.16 61.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 120.965 1.711 . . . . 0.0 108.791 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.05 71.79 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.296 -1.503 . . . . 0.0 110.045 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 13.3 mtp-105 -74.01 -8.24 55.38 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 117.043 -1.456 . . . . 0.0 111.957 173.35 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -61.82 1.82 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 123.144 2.702 . . . . 0.0 111.77 174.188 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -68.04 -18.66 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.108 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 75.1 p -95.98 -88.52 0.27 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -66.7 -56.93 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.575 1.15 . . . . 0.0 112.343 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 127.21 121.26 2.42 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.542 1.544 . . . . 0.0 110.557 -174.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.93 150.9 37.43 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.442 1.121 . . . . 0.0 112.013 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 35.4 t -78.14 164.59 24.84 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.789 1.635 . . . . 0.0 108.231 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.96 -42.04 99.71 Favored 'General case' 0 C--O 1.226 -0.164 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -69.64 -50.43 44.28 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 -176.274 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -60.49 -33.82 73.15 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.86 -0.525 . . . . 0.0 111.382 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . 0.441 ' HA ' HD12 ' A' ' 571' ' ' LEU . 52.9 ttt85 -66.22 -34.21 77.5 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.301 -0.875 . . . . 0.0 109.974 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 80.9 mt -73.09 -34.33 66.14 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.638 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -53.92 -36.43 62.74 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.328 0.967 . . . . 0.0 109.305 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . 0.441 HD12 ' HA ' ' A' ' 568' ' ' ARG . 6.3 mt -61.71 -39.32 91.08 Favored 'General case' 0 CA--C 1.519 -0.222 0 O-C-N 120.822 -1.174 . . . . 0.0 112.426 175.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -45.88 91.17 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.037 1.744 . . . . 0.0 108.148 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 3.7 m -66.37 -49.55 66.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 123.81 0.694 . . . . 0.0 109.285 -174.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 6.2 tp -55.1 -43.35 73.91 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.171 1.788 . . . . 0.0 111.286 175.123 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -64.56 -39.34 93.57 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.903 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -73.37 -34.15 65.42 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.649 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -67.04 -37.19 83.65 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 119.407 1.003 . . . . 0.0 109.469 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.0 mt -76.91 -20.83 55.72 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 120.487 -1.383 . . . . 0.0 109.718 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -74.03 -32.52 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.518 -0.738 . . . . 0.0 111.359 175.565 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -115.88 81.31 1.58 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.054 1.297 . . . . 0.0 110.84 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 173.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . 0.456 ' HE3' ' OD1' ' A' ' 537' ' ' ASP . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 49.18 76.15 0.13 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.206 1.402 . . . . 0.0 110.752 -178.668 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.6 t -100.31 140.39 34.62 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 124.825 1.25 . . . . 0.0 109.085 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 14.4 t -136.0 68.61 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 -175.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 mtm 49.42 29.76 3.0 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.005 0.922 . . . . 0.0 111.626 -176.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -112.06 -55.12 2.55 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 124.698 1.199 . . . . 0.0 108.464 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.7 mm -56.76 -46.81 83.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -54.51 -55.12 32.35 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.378 0.99 . . . . 0.0 110.356 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 23.2 mt -65.34 -49.04 80.86 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.933 -179.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.2 -38.88 96.35 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 124.048 0.833 . . . . 0.0 111.929 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.1 mt -66.37 -45.15 81.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.723 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -34.45 71.26 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.99 0.916 . . . . 0.0 111.871 174.89 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.23 -53.9 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 124.913 1.285 . . . . 0.0 109.942 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -80.63 -20.94 42.02 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 122.141 -0.35 . . . . 0.0 111.32 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 17.7 t-20 -130.07 81.05 69.75 Favored Pre-proline 0 C--N 1.323 -0.549 0 C-N-CA 124.001 0.921 . . . . 0.0 108.993 -173.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -64.56 -22.54 64.93 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.994 1.796 . . . . 0.0 111.21 -179.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.16 -22.58 62.96 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.155 0.982 . . . . 0.0 110.686 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 38.8 mt -63.67 -12.11 31.3 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.7 -1.25 . . . . 0.0 111.362 173.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -66.76 -28.05 68.09 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 120.907 -1.12 . . . . 0.0 111.209 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 31.9 m -83.65 -21.83 32.34 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.904 0.882 . . . . 0.0 110.906 173.812 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -14.8 47.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.777 0.717 . . . . 0.0 112.773 175.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 5.7 p -77.79 145.48 70.66 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 120.166 1.348 . . . . 0.0 109.21 176.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 13.3 Cg_endo -68.67 170.43 15.24 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.513 2.809 . . . . 0.0 111.483 173.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -74.46 12.92 0.99 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.413 2.742 . . . . 0.0 114.277 175.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 6.6 mp 72.46 43.07 0.5 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.153 2.181 . . . . 0.0 112.698 174.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -65.81 -30.76 71.44 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -126.06 17.41 7.85 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.566 1.546 . . . . 0.0 110.536 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.408 ' HG ' ' CZ ' ' A' ' 543' ' ' PHE . 61.3 mt -100.85 -101.68 0.25 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.246 1.019 . . . . 0.0 109.173 178.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.3 t0 70.97 147.15 0.07 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 128.141 2.577 . . . . 0.0 109.979 -173.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.85 -25.85 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.844 1.658 . . . . 0.0 109.622 173.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.16 -33.55 71.04 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 122.969 0.508 . . . . 0.0 111.229 175.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 54.9 mttt -92.38 -24.33 18.93 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 112.26 0.466 . . . . 0.0 112.26 176.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.84 96.15 38.36 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -177.015 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.16 67.31 4.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.579 2.852 . . . . 0.0 111.394 -174.497 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 163.52 -23.33 0.18 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 127.019 2.247 . . . . 0.0 112.308 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.1 tp -60.66 -23.98 65.23 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.633 -0.922 . . . . 0.0 110.814 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -49.07 -35.26 18.46 Favored Glycine 0 C--O 1.222 -0.655 0 CA-C-N 119.136 0.88 . . . . 0.0 111.326 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 6.4 tp -61.16 -43.44 98.87 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.72 1.26 . . . . 0.0 111.337 174.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.33 -51.25 61.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 124.572 1.149 . . . . 0.0 110.845 176.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -53.84 -50.6 65.85 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.596 0.634 . . . . 0.0 111.12 -178.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -50.91 69.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 117.851 0.296 . . . . 0.0 110.964 174.991 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 73.9 t -62.1 -45.61 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.264 176.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -55.61 -46.37 77.34 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.324 1.05 . . . . 0.0 109.353 -176.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 95.5 m -61.67 -46.77 88.29 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.178 2.191 . . . . 0.0 110.654 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 69.4 m -63.14 -44.16 96.33 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.155 0.889 . . . . 0.0 110.321 -178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -23.18 64.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.105 1.362 . . . . 0.0 112.085 174.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.28 -51.23 8.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.169 1.388 . . . . 0.0 110.293 177.397 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -71.3 100.48 0.3 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 127.062 2.145 . . . . 0.0 110.504 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.43 115.01 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.287 2.658 . . . . 0.0 111.574 -173.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.58 34.01 54.76 Favored Glycine 0 CA--C 1.522 0.478 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.252 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 15.9 tp -54.74 154.43 5.06 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.643 0.735 . . . . 0.0 110.242 174.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.96 163.98 26.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.2 1.4 . . . . 0.0 108.565 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -52.76 -45.32 67.01 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.911 0.884 . . . . 0.0 110.583 175.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -80.24 -31.96 36.62 Favored Glycine 0 C--N 1.338 0.691 0 CA-C-O 118.899 -0.945 . . . . 0.0 111.081 -176.51 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -40.24 95.71 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 118.363 1.081 . . . . 0.0 108.751 174.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 16.5 tp -52.93 -53.08 54.75 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.906 0.776 . . . . 0.0 109.562 177.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.69 -40.72 84.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.102 0.41 . . . . 0.0 111.661 176.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.14 -40.14 96.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.759 0.423 . . . . 0.0 111.078 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -67.4 -20.57 65.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.359 1.464 . . . . 0.0 111.646 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 66.5 m-85 -108.15 17.54 22.17 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.695 1.598 . . . . 0.0 109.217 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 15.5 ttt180 -59.7 133.88 56.5 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 119.901 -1.749 . . . . 0.0 110.166 -175.52 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 63.43 18.71 61.38 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 121.712 -0.618 . . . . 0.0 113.256 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 44.7 m -93.12 140.79 29.13 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -178.901 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -20.45 16.73 Favored 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -94.16 -19.5 20.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.068 1.347 . . . . 0.0 109.715 -179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -47.98 -45.53 31.65 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -53.75 -43.81 69.44 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.949 1.3 . . . . 0.0 112.1 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.5 m -62.85 -49.82 73.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.562 0.745 . . . . 0.0 109.042 173.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.1 mt -62.16 -35.73 79.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.404 1.081 . . . . 0.0 112.558 -178.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -34.29 62.07 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.583 2.353 . . . . 0.0 108.75 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.2 -43.31 98.51 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 173.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 24.4 mt -71.17 -22.39 62.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.548 1.139 . . . . 0.0 110.626 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 41.1 t -62.34 -53.99 46.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 120.744 1.611 . . . . 0.0 109.496 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.82 20.28 4.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.875 1.27 . . . . 0.0 111.397 -175.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -70.57 126.76 30.52 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.386 0.674 . . . . 0.0 111.324 -173.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.05 -2.45 37.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.06 1.344 . . . . 0.0 111.424 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -68.74 -27.68 66.14 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.818 -1.176 . . . . 0.0 111.988 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.82 -67.32 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 C-N-CA 126.026 1.731 . . . . 0.0 107.974 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 37.94 52.02 1.46 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.586 1.554 . . . . 0.0 112.14 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -148.27 167.84 24.09 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.947 1.299 . . . . 0.0 109.464 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -120.63 -32.41 4.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.091 2.156 . . . . 0.0 111.597 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -83.38 -55.05 4.54 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.261 1.424 . . . . 0.0 109.413 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.92 -25.89 39.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.256 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.9 -54.03 44.35 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.134 174.044 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -57.83 -46.03 85.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.19 0.995 . . . . 0.0 110.67 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -66.55 -46.92 74.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.767 -0.583 . . . . 0.0 110.104 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 41.6 m -62.25 -28.05 69.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.513 1.525 . . . . 0.0 110.453 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 43.0 t80 -66.23 -57.66 7.08 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 120.957 1.708 . . . . 0.0 108.641 176.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 17.8 m -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.346 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . 0.456 ' OD1' ' HE3' ' A' ' 447' ' ' LYS . 34.4 t0 -63.91 -46.81 83.15 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.452 1.024 . . . . 0.0 111.758 177.507 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 29.3 t -65.72 -48.74 70.94 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.032 1.333 . . . . 0.0 110.59 177.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.4 tt -55.27 -52.4 63.54 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-O 117.544 -1.217 . . . . 0.0 109.031 176.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -59.99 -40.19 88.33 Favored 'General case' 0 C--O 1.214 -0.798 0 O-C-N 124.04 0.838 . . . . 0.0 109.927 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -66.34 -32.8 74.42 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.492 1.042 . . . . 0.0 110.395 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 2.3 ttm -66.92 -58.99 3.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.408 ' CZ ' ' HG ' ' A' ' 474' ' ' LEU . 25.7 m-85 -57.88 -45.16 86.8 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.906 1.283 . . . . 0.0 110.166 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -55.6 -50.52 69.9 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.245 1.818 . . . . 0.0 109.513 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 5.0 t -57.97 -42.09 84.29 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 118.552 0.615 . . . . 0.0 110.187 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 17.6 mt -72.57 -35.2 67.89 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.371 0.987 . . . . 0.0 110.519 -177.436 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 26.5 mt -67.95 -40.0 83.34 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.241 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -62.19 -58.33 8.17 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 126.242 1.817 . . . . 0.0 108.379 174.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.98 -54.83 40.04 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.768 1.627 . . . . 0.0 109.814 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -49.85 76.16 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 124.88 1.272 . . . . 0.0 110.1 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -49.59 -56.02 11.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 116.245 -1.836 . . . . 0.0 108.656 173.634 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -60.3 -35.41 75.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.266 1.393 . . . . 0.0 109.956 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -44.81 88.86 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 121.565 -0.709 . . . . 0.0 111.197 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . 0.448 ' CD1' HD12 ' A' ' 571' ' ' LEU 0.267 0.0 OUTLIER -80.07 -44.81 19.4 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.372 177.689 . . . . . . . . 4 4 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -39.6 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.942 1.701 . . . . 0.0 108.043 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.76 -39.43 80.95 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.636 -1.29 . . . . 0.0 109.759 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.51 -13.08 18.12 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 116.014 -1.946 . . . . 0.0 110.01 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.47 -58.04 3.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 122.306 2.321 . . . . 0.0 109.256 173.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -63.59 -27.69 69.42 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' THR . . . . . 0.409 HG21 ' H ' ' A' ' 561' ' ' HIS . 1.6 t -99.6 -82.4 0.44 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . 0.409 ' H ' HG21 ' A' ' 560' ' ' THR . 1.6 t-80 -58.48 -40.95 84.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.049 -1.432 . . . . 0.0 113.798 -173.704 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 98.21 119.29 4.01 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -174.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -92.75 152.48 19.46 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 173.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.2 t -73.05 165.09 25.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -37.54 74.49 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.451 -0.781 . . . . 0.0 111.385 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -75.61 -53.21 8.95 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 124.532 1.145 . . . . 0.0 110.648 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -58.75 -40.43 83.82 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 118.96 0.8 . . . . 0.0 111.17 177.689 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -59.53 -33.61 71.6 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.138 1.335 . . . . 0.0 109.794 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 19.1 mt -72.36 -37.15 68.87 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 116.715 -1.612 . . . . 0.0 110.068 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.77 -41.1 43.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.841 1.655 . . . . 0.0 109.431 174.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . 0.448 HD12 ' CD1' ' A' ' 554' ' ' LEU . 0.8 OUTLIER -68.86 -38.35 79.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.949 -177.801 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -47.25 74.19 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 119.512 1.051 . . . . 0.0 109.018 173.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -52.55 63.51 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.1 tt -55.43 -36.44 66.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.284 1.434 . . . . 0.0 111.288 178.884 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -61.21 -39.76 91.45 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.155 -1.591 . . . . 0.0 111.474 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -78.41 -25.05 45.98 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.857 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -66.99 -38.95 86.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.558 1.143 . . . . 0.0 109.503 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 17.0 mt -84.02 -9.92 58.28 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.882 1.273 . . . . 0.0 112.683 173.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 47.04 42.68 13.02 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.082 1.753 . . . . 0.0 114.577 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -143.75 127.16 16.83 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.865 -1.147 . . . . 0.0 109.819 178.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 32.5 mttp . . . . . 0 N--CA 1.471 0.603 0 C-N-CA 125.329 1.452 . . . . 0.0 110.288 177.169 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.106 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 -150.92 -67.7 0.19 Allowed 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 173.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 30.7 m -90.8 89.47 7.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 15.2 t -145.18 61.86 1.3 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.914 1.686 . . . . 0.0 108.3 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 53.2 tpp 46.29 51.65 11.22 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.711 1.72 . . . . 0.0 110.721 178.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.01 -51.29 0.23 Allowed 'General case' 0 CA--C 1.486 -1.491 0 CA-C-O 117.007 -1.473 . . . . 0.0 108.848 -175.159 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 7.4 mm -58.74 -52.6 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 124.946 1.404 . . . . 0.0 107.709 176.106 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . 0.409 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 2.7 mt -56.78 -47.13 80.87 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 118.74 0.7 . . . . 0.0 110.75 -175.149 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 26.5 mt -62.22 -59.31 4.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 C-N-CA 123.851 0.86 . . . . 0.0 111.606 174.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.85 -38.14 96.04 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 120.833 1.651 . . . . 0.0 113.233 -173.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 47.2 mt -68.9 -38.16 79.44 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.776 173.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -65.96 -36.02 82.2 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.771 1.169 . . . . 0.0 109.86 173.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.7 t -60.91 -51.6 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 O-C-N 120.561 -1.337 . . . . 0.0 109.041 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.25 -20.24 55.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.719 0.807 . . . . 0.0 112.067 177.413 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -134.53 74.69 65.2 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 119.031 0.832 . . . . 0.0 109.316 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_endo -68.31 -18.52 44.5 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.575 1.516 . . . . 0.0 112.119 -175.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -65.84 -15.06 62.55 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.693 1.197 . . . . 0.0 110.857 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 43.1 mt -70.31 -12.28 61.48 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 120.437 -1.415 . . . . 0.0 109.01 173.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -58.82 -44.73 90.93 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.944 0.793 . . . . 0.0 109.195 173.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.6 m -70.3 -24.73 63.08 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.642 -1.286 . . . . 0.0 112.979 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.2 mt -83.92 -6.02 59.33 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.222 1.809 . . . . 0.0 111.393 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -93.82 157.87 37.38 Favored Pre-proline 0 CA--C 1.547 0.854 0 CA-C-N 121.041 1.746 . . . . 0.0 107.062 177.867 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -74.69 174.68 12.25 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.199 2.599 . . . . 0.0 111.076 173.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.58 8.73 2.14 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 124.777 3.651 . . . . 0.0 114.215 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . . 2.2 mm? 63.69 55.22 1.72 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 129.367 3.067 . . . . 0.0 111.919 178.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.22 -39.71 11.39 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.699 0.8 . . . . 0.0 112.383 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -84.22 6.9 20.92 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 120.687 -1.258 . . . . 0.0 113.851 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' LEU . . . . . 0.451 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 1.5 mp -128.66 -71.41 0.64 Allowed 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 125.569 1.547 . . . . 0.0 109.622 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 6.5 t70 60.71 162.61 0.06 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-O 122.909 1.338 . . . . 0.0 112.311 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -74.81 -14.63 60.71 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 120.569 -1.332 . . . . 0.0 111.107 178.24 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -63.28 -42.39 99.09 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.766 1.226 . . . . 0.0 109.752 174.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -49.4 22.15 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 118.941 -1.104 . . . . 0.0 108.328 -176.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -117.2 118.12 36.11 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.56 -173.778 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -72.3 -2.08 11.14 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.266 1.978 . . . . 0.0 112.614 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -107.0 -7.55 33.01 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.831 1.205 . . . . 0.0 110.621 173.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.9 tp -63.12 -32.69 74.13 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 116.441 -1.742 . . . . 0.0 108.742 177.883 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -52.4 -48.13 55.16 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 124.392 1.058 . . . . 0.0 110.775 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -44.32 97.0 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 121.547 -0.972 . . . . 0.0 111.928 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' PHE . . . . . 0.409 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 32.8 t80 -66.19 -42.53 88.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.271 0.628 . . . . 0.0 110.984 177.558 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -64.64 -48.21 75.67 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 116.679 -1.629 . . . . 0.0 107.254 -176.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.25 -44.2 97.08 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 125.497 1.519 . . . . 0.0 109.886 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.4 mt -55.47 -53.43 56.38 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.258 0.623 . . . . 0.0 111.005 176.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' VAL . . . . . . . . . . . . . 48.4 t -60.59 -46.78 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 116.214 -1.851 . . . . 0.0 110.361 174.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.03 -45.9 82.78 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 121.938 2.154 . . . . 0.0 110.361 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.8 m -62.34 -47.44 84.19 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 126.469 1.908 . . . . 0.0 109.2 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.7 m -60.28 -38.58 84.03 Favored 'General case' 0 CA--C 1.555 1.152 0 CA-C-N 119.182 0.901 . . . . 0.0 111.854 177.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.33 -21.26 61.83 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 129.058 2.943 . . . . 0.0 111.517 175.192 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 23.5 t -89.45 -64.82 1.09 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' GLN . . . . . 0.575 HE22 ' CD2' ' A' ' 506' ' ' HIS . 0.3 OUTLIER -57.2 98.4 0.15 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 125.437 1.495 . . . . 0.0 114.124 -173.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -70.48 127.85 14.58 Favored 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.155 1.903 . . . . 0.0 109.963 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 59.77 42.89 98.23 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 10.9 tp -56.26 159.53 3.47 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.398 1.094 . . . . 0.0 109.009 174.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -125.4 163.48 22.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.3 m -53.02 -44.5 67.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.781 1.232 . . . . 0.0 109.514 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -73.58 -41.91 42.08 Favored Glycine 0 N--CA 1.442 -0.911 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 4.1 tp-100 -58.93 -31.38 68.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 124.626 1.17 . . . . 0.0 111.849 -176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 35.4 tp -64.64 -57.35 9.29 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 174.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.9 mp -59.36 -33.17 70.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.236 0.471 . . . . 0.0 112.062 179.479 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.04 -48.46 65.57 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.497 1.119 . . . . 0.0 109.805 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' HIS . . . . . 0.575 ' CD2' HE22 ' A' ' 495' ' ' GLN . 68.5 t60 -63.29 -16.48 60.43 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.734 0.813 . . . . 0.0 112.417 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -111.94 16.18 20.43 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.269 1.827 . . . . 0.0 108.969 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -54.86 124.51 16.83 Favored 'General case' 0 C--O 1.227 -0.109 0 O-C-N 120.287 -1.508 . . . . 0.0 108.749 -177.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.77 37.48 61.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.821 -0.433 . . . . 0.0 112.03 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' THR . . . . . . . . . . . . . 28.9 m -108.61 152.78 24.32 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.781 1.232 . . . . 0.0 108.737 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -59.75 -25.58 64.98 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.369 1.068 . . . . 0.0 110.591 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' ASN . . . . . . . . . . . . . 9.7 m120 -92.31 -17.47 24.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 116.02 -1.943 . . . . 0.0 110.181 178.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.99 59.3 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 120.016 1.28 . . . . 0.0 109.476 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.25 -45.71 83.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.891 0.769 . . . . 0.0 112.701 -179.171 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 31.1 m -66.93 -44.05 81.67 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.709 -0.62 . . . . 0.0 109.696 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 61.8 mt -59.76 -40.15 87.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.539 1.536 . . . . 0.0 111.607 177.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -68.49 -42.76 78.19 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 127.019 2.128 . . . . 0.0 109.216 178.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -61.43 -36.4 80.26 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.525 -0.734 . . . . 0.0 109.625 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 32.0 mt -82.37 -8.87 59.63 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.978 0.911 . . . . 0.0 112.246 176.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.9 t -77.5 -56.66 4.35 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 124.956 1.303 . . . . 0.0 108.14 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.8 12.85 1.18 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.947 1.299 . . . . 0.0 113.274 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -68.53 128.44 36.63 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.189 -0.944 . . . . 0.0 110.903 -175.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.66 14.89 15.48 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.711 2.405 . . . . 0.0 110.043 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -65.99 -29.5 69.89 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 120.237 -1.54 . . . . 0.0 109.853 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -107.63 -48.85 8.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 C-N-CA 128.441 2.696 . . . . 0.0 110.363 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.81 34.28 0.41 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.253 2.221 . . . . 0.0 112.576 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -157.93 165.68 34.56 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.821 1.649 . . . . 0.0 108.155 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -114.56 -35.58 4.85 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.508 1.523 . . . . 0.0 109.365 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.25 -50.76 64.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.596 0.758 . . . . 0.0 110.051 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 2.3 mm -62.91 -28.5 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -57.44 -61.83 2.21 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 119.962 1.255 . . . . 0.0 109.111 175.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -54.46 -42.55 70.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.865 1.211 . . . . 0.0 110.612 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.05 -55.03 37.44 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 122.691 0.397 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 47.8 m -63.47 -31.71 72.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 117.414 -1.279 . . . . 0.0 109.102 178.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 34.8 t80 -63.16 -54.71 33.45 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.09 1.768 . . . . 0.0 107.676 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 90.8 m -59.84 -48.28 82.32 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.525 0.73 . . . . 0.0 109.551 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -58.22 -46.23 86.26 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.992 1.717 . . . . 0.0 111.666 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 13.2 t -69.12 -45.42 70.2 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 126.824 2.05 . . . . 0.0 111.723 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.5 tt -59.76 -47.26 86.37 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 120.098 1.317 . . . . 0.0 110.753 173.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -59.07 -40.06 84.02 Favored 'General case' 0 C--O 1.207 -1.177 0 O-C-N 120.772 -1.205 . . . . 0.0 113.085 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -64.36 -44.29 91.91 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -52.9 63.67 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' PHE . . . . . 0.451 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 2.9 m-85 -62.29 -40.59 96.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.304 1.041 . . . . 0.0 109.523 -175.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -62.21 -53.81 49.95 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.7 t -51.0 -46.33 61.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.404 1.482 . . . . 0.0 110.817 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 80.0 mt -69.01 -39.93 79.0 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 119.399 0.999 . . . . 0.0 111.121 -177.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 20.2 mt -66.31 -37.29 85.04 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.997 -1.478 . . . . 0.0 110.255 174.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.29 -56.32 13.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.789 2.036 . . . . 0.0 107.818 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 15.6 mt -59.34 -47.1 86.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.66 1.584 . . . . 0.0 108.244 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -47.13 72.54 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 -50.84 -55.75 15.48 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-O 114.097 -2.859 . . . . 0.0 107.798 175.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.08 -44.31 91.87 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 125.811 1.944 . . . . 0.0 110.21 -174.231 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -48.31 74.05 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.71 1.204 . . . . 0.0 109.61 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.252 0.2 OUTLIER -66.06 -44.33 84.83 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.818 -1.176 . . . . 0.0 109.207 176.236 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.3 mm -64.25 -38.58 82.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 120.567 1.531 . . . . 0.0 108.334 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.28 -38.73 66.2 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.657 1.983 . . . . 0.0 107.624 174.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -2.15 1.85 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 116.659 -1.639 . . . . 0.0 112.582 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -82.92 -27.24 30.76 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.625 1.557 . . . . 0.0 111.338 173.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -107.44 -30.28 8.76 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.642 1.11 . . . . 0.0 111.27 -177.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.8 p -77.22 -51.6 10.66 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -114.3 -36.66 4.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.224 1.41 . . . . 0.0 111.829 -176.619 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 102.96 128.4 6.36 Favored Glycine 0 C--N 1.339 0.727 0 C-N-CA 125.574 1.559 . . . . 0.0 110.124 -173.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 5.0 mt -87.4 153.23 21.6 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 173.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.75 168.52 11.24 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.282 178.926 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -58.14 -41.45 83.74 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -76.08 -53.61 8.08 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 123.276 0.63 . . . . 0.0 109.786 -178.006 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -60.78 -36.07 78.06 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.907 -177.542 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -59.56 -39.08 82.87 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 120.094 1.315 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 1.5 mp -74.94 -38.24 61.8 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 117.531 -1.223 . . . . 0.0 111.99 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -47.52 -40.8 19.57 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 120.244 1.384 . . . . 0.0 107.875 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -72.12 -34.93 68.96 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 115.971 -1.966 . . . . 0.0 110.978 -178.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -48.29 75.82 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 121.109 1.777 . . . . 0.0 107.886 173.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -26.27 68.22 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 8.0 tt -81.72 -34.08 30.76 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.556 1.542 . . . . 0.0 109.865 176.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.67 -44.78 92.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.82 1.648 . . . . 0.0 109.317 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -30.09 68.1 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.72 -35.2 67.5 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.429 -174.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 13.9 mt -81.54 -22.31 37.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.39 1.476 . . . . 0.0 112.891 173.989 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 50.83 81.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 128.996 2.918 . . . . 0.0 115.494 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -78.03 108.43 11.3 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.909 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 5.3 tptt . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 130.62 3.568 . . . . 0.0 111.593 173.463 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 111.35 0.129 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' ARG . . . . . 0.477 ' HB3' ' CH2' ' A' ' 522' ' ' TRP . 16.4 mtt180 -86.27 -50.63 6.81 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 120.234 -1.541 . . . . 0.0 109.362 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 16.0 mm -63.15 -52.45 58.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.1 -42.43 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.486 1.039 . . . . 0.0 111.656 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 68.5 mt -72.96 -58.61 4.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 CA-C-N 118.719 0.691 . . . . 0.0 110.264 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.21 -32.65 60.36 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.344 0.973 . . . . 0.0 112.383 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 531' ' ' ALA . 64.9 mt -69.14 -49.55 55.93 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 117.527 0.663 . . . . 0.0 109.664 173.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.63 -38.43 75.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.67 0.788 . . . . 0.0 111.346 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.31 -55.43 24.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.069 1.348 . . . . 0.0 109.241 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' GLN . . . . . 0.587 ' HA ' HG23 ' A' ' 500' ' ' THR . 2.4 mp0 -70.06 -20.82 63.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 118.823 -0.608 . . . . 0.0 112.43 -178.28 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -141.58 80.07 16.5 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.712 1.605 . . . . 0.0 110.369 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.81 -15.34 40.51 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.467 1.445 . . . . 0.0 112.897 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -68.14 -18.94 64.76 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.824 1.193 . . . . 0.0 110.214 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 535' ' ' PHE . 79.6 mt -63.48 -13.37 39.99 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 121.33 -0.856 . . . . 0.0 110.827 173.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.03 -26.48 68.29 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 118.789 0.722 . . . . 0.0 111.115 173.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 90.6 m -82.92 -17.48 43.51 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.595 1.089 . . . . 0.0 110.854 174.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.73 -8.34 50.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.112 0.965 . . . . 0.0 111.375 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 489' ' ' VAL . 9.9 p -88.47 145.47 35.58 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-N 119.82 1.191 . . . . 0.0 108.488 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.01 170.98 13.17 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.566 2.844 . . . . 0.0 111.484 174.45 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.09 13.95 0.59 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.467 3.445 . . . . 0.0 113.933 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.627 ' HA ' HD13 ' A' ' 474' ' ' LEU . 9.6 mp 64.05 18.35 11.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.645 1.978 . . . . 0.0 115.935 173.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -47.1 -42.22 18.66 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.712 1.605 . . . . 0.0 114.78 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.26 6.59 48.63 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.908 0.883 . . . . 0.0 112.633 -175.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.797 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.2 mp -115.06 -71.83 0.72 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.662 1.585 . . . . 0.0 108.595 -173.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 16.5 t70 59.97 166.9 0.07 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 123.256 1.503 . . . . 0.0 110.118 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.3 -6.19 59.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 119.688 -1.882 . . . . 0.0 110.605 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -81.91 -44.85 16.26 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.72 1.608 . . . . 0.0 112.021 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -76.36 -21.2 56.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 119.072 -0.489 . . . . 0.0 111.662 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 52.9 mt -125.27 96.5 39.17 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-O 118.141 -0.933 . . . . 0.0 108.692 -178.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.46 78.11 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.792 2.995 . . . . 0.0 111.197 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.96 -17.06 2.37 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.875 2.179 . . . . 0.0 113.834 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 11.6 tp -56.24 -27.43 54.96 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.615 2.207 . . . . 0.0 110.231 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.05 -36.77 9.38 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 118.998 -0.89 . . . . 0.0 112.816 174.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -47.44 81.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.752 1.776 . . . . 0.0 110.276 175.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -59.74 -49.99 75.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.376 1.07 . . . . 0.0 110.658 174.697 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -61.77 -45.88 91.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.439 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -57.46 -52.84 63.77 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.782 HD11 HD21 ' A' ' 516' ' ' LEU . 0.0 OUTLIER -55.69 -48.66 74.73 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.851 0.46 . . . . 0.0 112.028 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 468' ' ' VAL . 75.3 t -58.79 -49.88 81.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -58.06 -46.37 85.52 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.928 1.291 . . . . 0.0 109.942 -175.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.7 m -62.81 -41.51 99.33 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 126.499 1.92 . . . . 0.0 110.785 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 44.3 m -62.14 -45.35 93.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.388 1.449 . . . . 0.0 110.38 176.15 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -23.91 67.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.983 0.913 . . . . 0.0 112.253 174.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -15.29 53.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.618 1.167 . . . . 0.0 111.535 176.815 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.9 75.82 66.16 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 124.984 1.314 . . . . 0.0 108.776 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.41 121.39 9.35 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.021 1.814 . . . . 0.0 109.474 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 98.47 8.24 54.97 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.375 0.988 . . . . 0.0 113.421 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.01 152.55 36.57 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.435 1.118 . . . . 0.0 108.027 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 7.3 p -134.03 169.53 17.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.151 0.98 . . . . 0.0 109.031 -174.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.587 HG23 ' HA ' ' A' ' 460' ' ' GLN . 5.1 m -49.88 -48.33 51.47 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.607 1.563 . . . . 0.0 111.509 174.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -82.94 -41.45 8.69 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -174.299 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 51.4 tp60 -63.6 -24.84 67.97 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.449 1.1 . . . . 0.0 111.296 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 68.4 tp -55.58 -50.3 70.45 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.676 1.19 . . . . 0.0 110.451 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.61 -35.06 79.77 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' GLU . . . . . 0.563 ' OE1' ' HD3' ' A' ' 508' ' ' ARG . 1.0 OUTLIER -70.98 -31.59 68.18 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 117.85 0.295 . . . . 0.0 110.217 178.541 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -70.12 -20.71 63.16 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -112.57 17.22 19.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.034 1.733 . . . . 0.0 109.751 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' ARG . . . . . 0.563 ' HD3' ' OE1' ' A' ' 505' ' ' GLU . 6.6 tpt180 -55.13 120.36 6.86 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.785 -1.197 . . . . 0.0 109.98 -174.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.43 18.25 78.13 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 118.641 -1.088 . . . . 0.0 113.542 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.827 HG22 ' H ' ' A' ' 512' ' ' ASN . 30.0 m -92.79 150.59 20.53 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.545 1.672 . . . . 0.0 107.998 -175.443 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -57.72 -20.83 37.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.897 0.856 . . . . 0.0 112.385 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.827 ' H ' HG22 ' A' ' 510' ' ' THR . 11.6 m-20 -93.39 -17.91 22.97 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.819 1.247 . . . . 0.0 109.703 -177.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -54.29 -38.44 65.91 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.208 1.403 . . . . 0.0 110.971 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.1 88.74 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.822 1.192 . . . . 0.0 111.868 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 32.1 m -65.63 -43.16 90.35 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.679 0.792 . . . . 0.0 109.712 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.782 HD21 HD11 ' A' ' 488' ' ' LEU . 13.1 mt -66.7 -32.78 74.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.276 0.631 . . . . 0.0 112.09 179.143 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.19 -44.52 96.42 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.84 1.656 . . . . 0.0 108.413 174.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.37 -37.38 83.16 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 123.714 0.805 . . . . 0.0 109.899 -177.414 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.35 -31.04 38.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.89 1.676 . . . . 0.0 114.277 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.4 t -70.33 -53.85 14.99 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 124.989 1.315 . . . . 0.0 110.53 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -71.24 9.73 0.71 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.782 1.633 . . . . 0.0 114.03 175.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.477 ' CH2' ' HB3' ' A' ' 452' ' ' ARG . 0.8 OUTLIER -78.33 85.61 4.45 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.925 1.29 . . . . 0.0 113.512 -173.451 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -2.63 1.25 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.632 1.973 . . . . 0.0 112.998 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.78 -0.93 10.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.514 1.526 . . . . 0.0 112.503 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -150.17 -63.14 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 127.463 2.305 . . . . 0.0 109.869 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.62 21.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.272 2.629 . . . . 0.0 116.97 173.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -116.75 177.36 4.73 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.5 1.12 . . . . 0.0 110.041 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -135.11 -30.11 1.07 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 126.775 2.03 . . . . 0.0 112.011 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -81.81 -56.28 4.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.319 1.447 . . . . 0.0 109.167 174.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.51 -28.23 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.799 1.24 . . . . 0.0 108.179 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.44 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -53.88 -50.63 65.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.002 0.819 . . . . 0.0 111.718 177.837 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.53 -49.95 67.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.829 0.74 . . . . 0.0 109.692 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -48.81 73.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.692 0.797 . . . . 0.0 110.916 177.134 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.1 m -66.23 -32.42 73.83 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 118.161 -0.923 . . . . 0.0 109.083 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.408 ' CD1' HD13 ' A' ' 464' ' ' LEU . 37.9 t80 -63.78 -54.1 40.5 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 120.519 1.509 . . . . 0.0 108.906 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 29.8 m -58.89 -45.97 88.97 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.385 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.57 -41.68 98.38 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.974 1.261 . . . . 0.0 112.165 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.6 t -64.21 -49.84 70.42 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.68 1.992 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 3.7 tt -55.51 -50.04 71.01 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 124.65 1.18 . . . . 0.0 108.002 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -55.69 -44.61 77.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.814 0.846 . . . . 0.0 108.812 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -61.84 -44.47 96.76 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.192 0.905 . . . . 0.0 110.538 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -51.26 70.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.326 -0.858 . . . . 0.0 108.736 178.037 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.797 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.8 m-85 -59.96 -49.33 78.09 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 123.823 0.849 . . . . 0.0 109.883 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -50.39 -52.11 40.31 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.481 2.312 . . . . 0.0 110.092 177.081 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -44.19 91.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.547 1.139 . . . . 0.0 112.132 176.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.37 -39.6 92.51 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 120.888 -1.133 . . . . 0.0 111.355 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 23.9 mt -67.49 -38.72 84.76 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.229 1.412 . . . . 0.0 108.891 176.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.25 -51.19 69.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.621 1.568 . . . . 0.0 109.44 174.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.94 -47.78 81.89 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.91 -45.13 93.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 117.742 -1.123 . . . . 0.0 109.73 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -52.89 56.14 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.393 1.077 . . . . 0.0 109.853 175.417 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -36.03 82.82 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.166 -177.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -62.03 -43.98 97.68 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 111.491 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.443 ' HB3' HD11 ' A' ' 571' ' ' LEU . 12.2 mt -63.06 -55.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.944 1.298 . . . . 0.0 108.485 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.06 -37.26 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.8 66.87 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 120.084 -1.635 . . . . 0.0 111.659 174.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -96.22 0.01 50.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 116.629 -1.653 . . . . 0.0 112.476 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.59 -44.72 11.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 121.406 1.912 . . . . 0.0 110.617 174.319 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 1.1 11.74 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.053 1.341 . . . . 0.0 113.471 -173.63 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 561' ' ' HIS . 5.1 t -139.73 -88.74 0.19 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -178.518 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.696 ' H ' HG23 ' A' ' 560' ' ' THR . 0.7 OUTLIER -50.67 -49.64 56.76 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.767 0.827 . . . . 0.0 111.831 -176.876 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.79 87.79 1.38 Allowed Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 107.341 -2.304 . . . . 0.0 107.341 -175.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 163.27 10.59 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 173.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 32.3 p -67.37 170.13 7.84 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.431 -0.793 . . . . 0.0 111.737 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -64.21 -38.08 89.79 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -64.02 -49.66 71.53 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 124.829 1.252 . . . . 0.0 108.624 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.09 -37.22 84.24 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.816 1.644 . . . . 0.0 110.637 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.648 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.2 OUTLIER -66.98 -30.1 70.13 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.311 1.445 . . . . 0.0 112.541 174.663 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 13.5 mt -78.86 -38.68 37.27 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-O 117.529 -1.224 . . . . 0.0 109.286 173.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -53.27 -42.35 66.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 119.508 1.049 . . . . 0.0 108.463 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 568' ' ' ARG . 10.4 mt -53.09 -44.77 67.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.714 1.206 . . . . 0.0 112.736 173.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -52.13 67.01 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 120.113 1.324 . . . . 0.0 109.182 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.41 -45.26 92.0 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.886 0.742 . . . . 0.0 109.861 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 4.3 tp -61.17 -39.16 89.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.998 1.319 . . . . 0.0 111.215 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -65.77 -36.39 83.42 Favored 'General case' 0 C--O 1.227 -0.097 0 C-N-CA 123.864 0.866 . . . . 0.0 109.659 177.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 11.7 tp60 -67.91 -38.46 82.97 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 110.664 176.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.27 -36.42 82.93 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.756 0.822 . . . . 0.0 110.273 176.537 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.0 mt . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 123.902 0.881 . . . . 0.0 109.762 -177.415 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 122.215 1.007 . . . . 0.0 112.138 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -64.93 -26.41 68.3 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-O 116.066 -1.921 . . . . 0.0 110.112 175.045 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.457 HD13 ' CH2' ' A' ' 522' ' ' TRP . 15.8 mm -66.6 -52.87 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 O-C-N 125.494 1.746 . . . . 0.0 108.33 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.508 HD23 ' CE1' ' A' ' 535' ' ' PHE . 12.5 mt -52.97 -45.25 67.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.662 1.119 . . . . 0.0 111.73 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.559 HD13 HD12 ' A' ' 484' ' ' LEU . 41.5 mt -71.55 -60.82 2.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-O 118.128 -0.939 . . . . 0.0 111.337 177.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -48.6 -43.51 28.67 Favored Glycine 0 C--O 1.227 -0.344 0 C-N-CA 126.088 1.804 . . . . 0.0 112.841 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.999 HD21 HG21 ' A' ' 525' ' ' ILE . 55.1 mt -66.25 -42.4 88.63 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 116.282 -1.818 . . . . 0.0 108.525 173.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.521 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.9 tm? -65.17 -28.62 69.52 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 120.89 1.677 . . . . 0.0 111.502 176.337 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 455' ' ' ILE . 31.4 t -66.66 -55.17 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -81.57 -11.52 59.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.015 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.793 ' HB3' HD12 ' A' ' 464' ' ' LEU . 5.0 t-20 -130.5 74.76 79.89 Favored Pre-proline 0 N--CA 1.447 -0.591 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 462' ' ' PRO . . . . . 0.723 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.6 Cg_endo -65.01 -18.79 63.05 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 120.979 1.119 . . . . 0.0 112.197 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.18 -19.71 62.37 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.261 -0.899 . . . . 0.0 111.211 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' A' ' 461' ' ' ASN . 17.2 mt -69.79 -13.58 62.35 Favored 'General case' 0 N--CA 1.461 0.075 0 CA-C-N 118.593 0.633 . . . . 0.0 111.169 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.58 -32.84 72.96 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 117.579 0.172 . . . . 0.0 110.965 174.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.3 m -79.04 -21.17 47.25 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.469 -0.769 . . . . 0.0 111.693 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 464' ' ' LEU . 0.5 OUTLIER -81.75 -19.26 41.73 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 121.513 -0.742 . . . . 0.0 110.297 174.891 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 489' ' ' VAL . 2.2 p -64.31 147.57 96.93 Favored Pre-proline 0 N--CA 1.444 -0.749 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -178.261 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.2 Cg_endo -74.5 172.77 15.49 Favored 'Trans proline' 0 N--CA 1.434 -1.985 0 C-N-CA 121.492 1.461 . . . . 0.0 109.829 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -75.42 4.4 4.98 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 124.172 3.248 . . . . 0.0 112.475 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.547 ' CD2' HD11 ' A' ' 482' ' ' LEU . 3.9 mp 66.21 68.58 0.44 Allowed 'General case' 0 C--N 1.348 0.537 0 C-N-CA 124.136 0.975 . . . . 0.0 109.132 177.494 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.98 -70.53 0.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.92 0.866 . . . . 0.0 110.215 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.64 31.17 5.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.732 0.813 . . . . 0.0 109.375 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.605 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.2 OUTLIER -90.26 -89.15 0.16 Allowed 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -177.364 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.7 t70 64.19 158.44 0.09 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.417 1.58 . . . . 0.0 110.324 -178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.493 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 18.1 mt-10 -81.84 -16.26 51.36 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 120.4 -1.438 . . . . 0.0 109.094 173.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.76 -19.93 66.08 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 123.095 1.426 . . . . 0.0 112.801 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -101.27 -26.04 13.77 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 113.977 -1.465 . . . . 0.0 111.447 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 9.5 mt -142.52 116.11 6.38 Favored Pre-proline 0 N--CA 1.442 -0.832 0 O-C-N 124.127 0.892 . . . . 0.0 110.213 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.1 -44.2 13.15 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.269 1.979 . . . . 0.0 109.791 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -79.15 -20.91 68.81 Favored Glycine 0 C--N 1.339 0.697 0 O-C-N 120.396 -1.44 . . . . 0.0 112.117 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.547 HD11 ' CD2' ' A' ' 471' ' ' LEU . 1.9 tm? -55.14 -37.2 66.65 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 118.003 0.902 . . . . 0.0 110.203 174.675 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.493 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -51.17 -47.07 50.63 Favored Glycine 0 C--O 1.221 -0.709 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.33 175.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.676 HD13 HD12 ' A' ' 488' ' ' LEU . 1.2 tm? -52.06 -51.97 54.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.039 1.42 . . . . 0.0 111.639 176.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.48 ' CZ ' HD22 ' A' ' 454' ' ' LEU . 24.8 t80 -55.84 -51.9 65.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.812 0.845 . . . . 0.0 110.382 175.329 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.434 HH21 ' CG ' ' A' ' 490' ' ' ASN . 0.0 OUTLIER -59.88 -46.26 89.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.178 0.591 . . . . 0.0 111.372 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -63.2 -47.83 80.88 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 127.026 2.13 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.941 HD11 HD21 ' A' ' 516' ' ' LEU . 0.4 OUTLIER -57.06 -46.12 82.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.257 176.182 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 468' ' ' VAL . 72.1 t -63.48 -41.95 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 CA-C-O 117.069 -1.443 . . . . 0.0 108.708 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 490' ' ' ASN . . . . . 0.434 ' CG ' HH21 ' A' ' 486' ' ' ARG . 27.1 t-20 -54.43 -43.03 71.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 120.95 1.704 . . . . 0.0 110.779 -177.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 17.7 m -70.13 -48.35 57.84 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.803 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.538 ' SG ' HD22 ' A' ' 498' ' ' LEU . 72.7 m -59.46 -36.07 75.28 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 118.993 0.815 . . . . 0.0 111.662 177.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.663 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.3 OUTLIER -60.73 -15.19 26.69 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 128.115 2.566 . . . . 0.0 111.583 174.369 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.3 t -95.57 -57.74 2.3 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-O 116.59 -1.671 . . . . 0.0 108.087 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.448 ' CB ' HD13 ' A' ' 498' ' ' LEU . 27.7 mm100 -57.91 104.24 0.41 Allowed Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.662 1.585 . . . . 0.0 110.469 -175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -79.24 122.68 5.28 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 123.01 2.474 . . . . 0.0 111.318 -174.063 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 67.3 33.15 81.59 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 118.623 -1.751 . . . . 0.0 112.71 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 462' ' ' PRO . 2.9 tp -64.42 148.49 50.39 Favored 'General case' 0 CA--C 1.506 -0.744 0 O-C-N 120.939 -1.33 . . . . 0.0 111.346 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 499' ' ' THR . . . . . 0.444 ' N ' ' HG ' ' A' ' 498' ' ' LEU . 1.1 p -112.05 169.16 9.04 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.96 1.704 . . . . 0.0 110.135 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.6 m -64.66 -35.51 81.26 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.12 -46.9 33.1 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 108.189 -1.964 . . . . 0.0 108.189 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -43.67 55.72 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.48 -173.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 28.5 tp -52.5 -54.89 26.5 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 118.63 0.65 . . . . 0.0 112.218 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.87 -34.84 65.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.941 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.11 -44.24 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 119.467 1.03 . . . . 0.0 112.23 175.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -68.54 -13.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.453 1.501 . . . . 0.0 111.146 176.495 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.657 ' CD2' HG21 ' A' ' 510' ' ' THR . 37.3 m-85 -118.36 18.56 13.63 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 125.425 1.49 . . . . 0.0 108.728 178.759 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -58.33 -20.49 43.72 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.795 1.634 . . . . 0.0 112.617 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -137.71 42.48 1.29 Allowed Glycine 0 N--CA 1.438 -1.172 0 C-N-CA 124.454 1.026 . . . . 0.0 111.141 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.781 HG22 ' H ' ' A' ' 512' ' ' ASN . 51.3 m -105.43 139.57 39.85 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.583 1.191 . . . . 0.0 109.041 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.03 -20.5 17.07 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 119.967 -1.708 . . . . 0.0 113.237 175.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.781 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m120 -94.53 -16.91 22.89 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 125.8 1.64 . . . . 0.0 112.173 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -43.88 -37.31 2.77 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 125.64 1.576 . . . . 0.0 110.589 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.79 -60.8 2.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.509 1.524 . . . . 0.0 110.392 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 51.5 m -61.93 -40.75 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.889 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' ' 488' ' ' LEU . 17.4 mt -60.7 -31.34 70.62 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 119.128 0.876 . . . . 0.0 111.171 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.06 -41.53 64.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 122.171 0.986 . . . . 0.0 110.987 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -34.72 78.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.179 174.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.43 HD13 HG22 ' A' ' 455' ' ' ILE . 92.1 mt -77.19 -8.86 58.27 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 116.525 -1.702 . . . . 0.0 112.195 174.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.5 t -76.16 -67.67 0.66 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.414 1.886 . . . . 0.0 109.264 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -2.07 8.36 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.536 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.4 t90 -49.37 136.67 15.64 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 123.02 0.528 . . . . 0.0 109.967 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.77 3.24 8.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 124.887 1.275 . . . . 0.0 108.457 -174.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -53.81 -37.78 63.9 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.515 1.15 . . . . 0.0 112.21 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.999 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -93.29 -55.71 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 113.308 -1.769 . . . . 0.0 109.027 179.421 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 45.95 40.07 6.38 Favored 'General case' 0 C--N 1.344 0.343 0 O-C-N 124.612 1.195 . . . . 0.0 110.838 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -159.47 153.21 22.92 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.94 -25.77 10.57 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.722 1.209 . . . . 0.0 111.388 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.43 -62.83 1.51 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 124.042 0.937 . . . . 0.0 109.617 177.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 80.1 mt -52.39 -32.89 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.748 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -49.11 -58.42 4.99 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.006 175.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -50.34 -42.52 53.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.411 1.459 . . . . 0.0 113.14 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -51.68 63.15 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.795 176.159 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 534' ' ' THR . . . . . 0.43 HG22 HG21 ' A' ' 453' ' ' ILE . 17.0 m -61.72 -28.49 69.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.364 1.466 . . . . 0.0 110.031 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.624 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.0 t80 -69.08 -59.75 2.82 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 126.491 1.916 . . . . 0.0 109.816 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 35.3 m -61.18 -39.81 91.54 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 124.028 0.83 . . . . 0.0 109.259 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -56.86 -45.68 82.31 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.27 0.941 . . . . 0.0 110.195 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 3.6 t -65.18 -49.52 69.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.671 0.788 . . . . 0.0 111.461 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.461 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -55.4 -43.39 75.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.053 177.41 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.06 -41.21 96.18 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-O 116.166 -1.873 . . . . 0.0 107.46 176.192 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -68.73 -37.26 79.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 120.782 1.628 . . . . 0.0 109.569 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.8 ttp -62.58 -55.78 24.05 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.817 0.847 . . . . 0.0 110.413 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.697 ' HA ' HD12 ' A' ' 546' ' ' LEU . 6.3 m-85 -56.06 -45.52 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.367 1.867 . . . . 0.0 110.893 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -59.05 -48.96 79.7 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 126.214 1.806 . . . . 0.0 109.087 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' SER . . . . . 0.422 ' O ' ' HG ' ' A' ' 549' ' ' LEU . 3.1 t -56.28 -45.66 80.05 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.5 mt -63.16 -46.61 86.37 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.998 -1.064 . . . . 0.0 110.495 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 28.4 mt -60.62 -37.81 82.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.826 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.74 -52.63 35.25 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.632 1.573 . . . . 0.0 109.613 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 549' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 545' ' ' SER . 14.6 mt -56.28 -45.47 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.309 1.044 . . . . 0.0 108.702 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 35.7 ttt85 -55.15 -54.83 38.32 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.963 175.155 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.4 -55.31 9.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.207 1.567 . . . . 0.0 109.306 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.56 -38.52 81.34 Favored 'General case' 0 N--CA 1.442 -0.858 0 O-C-N 123.71 0.631 . . . . 0.0 109.982 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.74 -40.17 87.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 119.05 0.841 . . . . 0.0 112.818 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.754 ' HB2' HD21 ' A' ' 571' ' ' LEU . 2.4 mt -66.8 -51.1 59.64 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.55 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.475 HD13 HD13 ' A' ' 571' ' ' LEU . 38.4 mm -64.9 -38.68 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 CA-C-O 122.976 1.369 . . . . 0.0 110.843 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.42 65.93 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 119.843 -1.786 . . . . 0.0 109.949 174.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -106.26 11.65 30.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 125.51 1.524 . . . . 0.0 110.732 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 563' ' ' LEU . 0.9 OUTLIER -98.93 -29.8 12.73 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.994 1.27 . . . . 0.0 110.641 177.922 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -22.23 17.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.075 -178.049 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -96.55 -68.88 0.78 Allowed 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.222 1.487 . . . . 0.0 108.14 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -43.69 18.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.352 178.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 79.68 79.33 0.84 Allowed Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.552 HD11 ' HB2' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -44.9 157.65 0.07 Allowed 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 125.563 1.545 . . . . 0.0 110.743 172.503 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.16 157.95 7.61 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.597 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.446 ' O ' HD23 ' A' ' 569' ' ' LEU . 1.8 m-20 -53.07 -43.23 66.56 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.466 175.74 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.39 -46.74 88.9 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.158 177.27 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -60.59 -35.43 76.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.3 0.571 . . . . 0.0 111.478 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.507 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -65.02 -37.71 88.53 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.444 -0.785 . . . . 0.0 111.648 175.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.446 HD23 ' O ' ' A' ' 565' ' ' ASN . 4.2 mm? -66.55 -41.07 89.25 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-O 117.454 -1.26 . . . . 0.0 109.024 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -50.91 -38.3 49.18 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.807 0.813 . . . . 0.0 110.966 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 554' ' ' LEU . 2.0 mt -63.07 -46.59 86.76 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 118.002 -0.999 . . . . 0.0 112.21 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -50.68 52.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.711 1.141 . . . . 0.0 108.981 173.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -33.89 73.5 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -176.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -39.79 64.93 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.65 1.58 . . . . 0.0 111.036 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -56.97 -45.46 82.87 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.905 0.882 . . . . 0.0 108.869 174.561 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -66.3 -31.63 72.55 Favored 'General case' 0 C--O 1.189 -2.093 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 175.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . 0.265 0.3 OUTLIER -68.87 -23.08 64.17 Favored 'General case' 0 CA--C 1.497 -1.084 0 C-N-CA 129.72 3.208 . . . . 0.0 115.06 174.336 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 -174.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 120.55 0.215 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.62 -30.47 41.43 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.515 -1.707 . . . . 0.0 109.836 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.561 HG21 ' HB2' ' A' ' 538' ' ' SER . 18.5 mm -61.98 -42.47 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 119.92 1.236 . . . . 0.0 109.458 175.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.485 ' CD2' ' HE3' ' A' ' 542' ' ' MET . 4.2 mm? -60.85 -52.75 63.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.644 -173.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.583 HG23 HD13 ' A' ' 488' ' ' LEU . 23.0 mt -65.5 -50.37 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 C-N-CA 124.665 1.186 . . . . 0.0 108.123 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -53.59 -50.32 53.94 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 126.074 1.797 . . . . 0.0 113.344 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.785 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -69.48 -47.41 64.01 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.291 -0.955 . . . . 0.0 109.046 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 465' ' ' ALA . 3.2 tm? -59.83 -33.22 71.47 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.431 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 2.4 t -60.27 -52.32 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 126.149 1.78 . . . . 0.0 108.434 175.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -76.34 -23.61 54.22 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 122.891 0.476 . . . . 0.0 111.97 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.449 ' HB3' HD12 ' A' ' 464' ' ' LEU . 6.0 t-20 -129.76 74.0 81.04 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 124.79 1.236 . . . . 0.0 110.097 -173.712 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -61.81 -19.5 65.75 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.282 1.988 . . . . 0.0 111.701 -174.554 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.87 -17.12 63.94 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.946 1.298 . . . . 0.0 111.607 173.604 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.566 HD22 ' CD2' ' A' ' 535' ' ' PHE . 19.1 mt -63.98 -13.43 46.25 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 120.113 -1.617 . . . . 0.0 109.965 173.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.557 ' HB1' HD23 ' A' ' 493' ' ' LEU . . . -65.23 -38.99 92.12 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 88.5 m -71.68 -18.26 62.19 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.001 1.273 . . . . 0.0 112.464 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.1 mt -87.93 -22.13 24.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.578 1.151 . . . . 0.0 112.29 173.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.696 ' CG1' HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -80.08 146.85 64.09 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.189 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.469 ' O ' HD12 ' A' ' 471' ' ' LEU . 23.9 Cg_endo -75.43 174.23 13.15 Favored 'Trans proline' 0 CA--C 1.553 1.426 0 C-N-CA 122.384 2.056 . . . . 0.0 111.494 174.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 470' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 469' ' ' PRO . 45.0 Cg_endo -69.34 4.37 2.05 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 125.115 3.877 . . . . 0.0 114.113 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 482' ' ' LEU . 5.5 mp 71.76 55.62 0.19 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.647 2.379 . . . . 0.0 112.442 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.86 -25.98 44.01 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 -178.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.29 2.08 10.27 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.714 1.206 . . . . 0.0 112.212 -176.589 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.454 HD21 ' CE1' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -88.38 -75.99 0.41 Allowed 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 126.008 1.723 . . . . 0.0 106.933 -173.486 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 9.9 t70 63.73 159.03 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 O-C-N 125.452 1.72 . . . . 0.0 112.542 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -93.77 -16.02 24.59 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 119.981 -1.7 . . . . 0.0 110.444 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.69 -22.38 43.49 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.286 2.235 . . . . 0.0 112.383 175.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -16.78 33.22 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 119.081 0.855 . . . . 0.0 111.664 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.44 103.92 6.53 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 123.397 0.679 . . . . 0.0 110.855 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.77 77.84 0.73 Allowed 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.603 3.536 . . . . 0.0 110.004 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.03 -11.08 3.09 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.866 1.698 . . . . 0.0 113.409 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.672 HD11 HD23 ' A' ' 471' ' ' LEU . 2.0 tm? -65.09 -34.31 78.11 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.434 1.617 . . . . 0.0 109.437 173.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.31 -38.47 12.71 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 119.254 0.933 . . . . 0.0 112.875 175.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 488' ' ' LEU . 0.5 OUTLIER -57.29 -55.05 39.74 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 117.791 0.796 . . . . 0.0 109.581 174.275 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -55.99 -47.43 77.72 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.728 0.811 . . . . 0.0 111.29 177.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -49.38 73.74 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.66 -38.76 80.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.738 1.215 . . . . 0.0 111.407 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.6 -49.72 76.68 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 125.688 1.595 . . . . 0.0 110.436 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.696 HG11 ' CG1' ' A' ' 468' ' ' VAL . 69.2 t -60.47 -49.94 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 CA-C-O 117.324 -1.322 . . . . 0.0 107.467 173.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -51.93 -45.48 64.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.121 1.328 . . . . 0.0 109.784 -175.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.9 m -64.1 -49.46 72.16 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 125.095 1.358 . . . . 0.0 110.45 173.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' A' ' 458' ' ' LEU . 98.9 m -58.18 -36.95 73.82 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.478 1.49 . . . . 0.0 113.216 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.557 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.5 OUTLIER -61.11 -21.68 63.93 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 130.044 3.338 . . . . 0.0 112.156 173.876 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.9 t -93.41 -61.72 1.51 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 174.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.422 ' HB3' HD13 ' A' ' 498' ' ' LEU . 63.8 mm-40 -48.91 91.88 0.04 OUTLIER Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 128.85 2.86 . . . . 0.0 112.206 -173.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -70.66 123.85 10.18 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.336 2.024 . . . . 0.0 111.345 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.07 37.72 94.92 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.441 HD21 HD13 ' A' ' 503' ' ' LEU . 22.6 tp -59.37 162.28 4.89 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.786 0.803 . . . . 0.0 110.187 175.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.75 164.32 29.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.024 1.33 . . . . 0.0 107.555 -176.497 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.7 m -52.37 -46.16 66.08 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.934 1.294 . . . . 0.0 110.268 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.24 -44.16 23.49 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.83 -26.9 68.98 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.011 0.925 . . . . 0.0 111.142 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.441 HD13 HD21 ' A' ' 498' ' ' LEU . 42.2 tp -60.6 -54.33 46.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.14 -32.72 73.35 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.711 0.805 . . . . 0.0 111.159 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.07 -44.31 80.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.574 1.15 . . . . 0.0 111.243 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -63.93 -18.27 64.06 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.245 1.818 . . . . 0.0 112.638 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.5 ' CD2' HD13 ' A' ' 516' ' ' LEU . 55.3 m-85 -113.13 18.57 17.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 127.29 2.236 . . . . 0.0 111.11 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.8 125.07 20.75 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.482 -1.386 . . . . 0.0 109.874 -176.38 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.65 37.55 61.69 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.769 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.4 m -108.44 151.48 26.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.058 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -61.29 -24.88 66.73 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.846 1.259 . . . . 0.0 110.678 173.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.769 ' H ' HG22 ' A' ' 510' ' ' THR . 10.2 m-80 -91.97 -16.91 25.89 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-O 116.979 -1.486 . . . . 0.0 109.909 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.98 -45.79 51.9 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-N 119.567 1.076 . . . . 0.0 108.661 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.47 -46.13 84.04 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 81.4 m -64.16 -47.59 79.27 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 118.504 -0.76 . . . . 0.0 109.244 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 488' ' ' LEU . 82.1 mt -58.39 -41.16 84.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.698 1.599 . . . . 0.0 110.79 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -41.79 74.43 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 127.155 2.182 . . . . 0.0 109.301 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -62.0 -41.11 97.7 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.373 -1.299 . . . . 0.0 108.533 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.402 HD13 HG22 ' A' ' 455' ' ' ILE . 92.8 mt -73.3 -16.55 61.37 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 175.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.7 t -70.4 -36.59 74.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.137 1.375 . . . . 0.0 109.6 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.39 2.74 31.56 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.108 1.763 . . . . 0.0 113.406 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.42 ' CE3' HD11 ' A' ' 525' ' ' ILE . 14.3 t90 -75.7 73.56 2.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.75 1.22 . . . . 0.0 108.693 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.45 -13.12 47.1 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.243 2.617 . . . . 0.0 111.182 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -52.61 -20.06 2.77 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.254 2.622 . . . . 0.0 113.205 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.785 HD13 ' CD2' ' A' ' 457' ' ' LEU . 54.0 mt -51.81 -69.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 128.813 2.845 . . . . 0.0 111.459 175.26 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -162.7 -94.79 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.77 1.294 . . . . 0.0 110.537 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -152.84 164.56 37.62 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.5 2.72 . . . . 0.0 108.22 -176.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -21.35 64.78 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 120.097 1.317 . . . . 0.0 113.829 174.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.22 -57.42 3.27 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.937 1.695 . . . . 0.0 108.769 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 16.3 mt -71.17 -2.07 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.504 1.522 . . . . 0.0 110.199 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.498 ' HB1' ' CD1' ' A' ' 457' ' ' LEU . . . -56.56 -64.08 0.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.666 1.121 . . . . 0.0 108.258 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 532' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 464' ' ' LEU . 30.7 tt0 -55.47 -35.81 65.91 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.827 0.451 . . . . 0.0 111.285 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -51.19 59.36 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 117.346 -1.311 . . . . 0.0 110.473 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 52.6 m -57.96 -36.7 72.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.615 1.966 . . . . 0.0 110.079 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.566 ' CD2' HD22 ' A' ' 464' ' ' LEU . 73.3 t80 -62.22 -56.01 22.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.464 -0.779 . . . . 0.0 110.75 175.374 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 52.3 m -62.34 -42.52 99.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.089 -0.958 . . . . 0.0 108.944 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.42 -47.26 82.22 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.87 1.268 . . . . 0.0 110.201 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' SER . . . . . 0.561 ' HB2' HG21 ' A' ' 453' ' ' ILE . 8.7 t -66.68 -44.53 81.53 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.164 0.986 . . . . 0.0 110.919 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.402 ' CD1' HG23 ' A' ' 468' ' ' VAL . 1.0 OUTLIER -55.46 -51.09 68.07 Favored 'General case' 0 C--O 1.202 -1.421 0 C-N-CA 125.157 1.383 . . . . 0.0 108.935 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -60.14 -43.94 95.33 Favored 'General case' 0 C--N 1.372 1.564 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -66.36 -38.52 87.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 120.046 -1.659 . . . . 0.0 111.59 -178.027 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' MET . . . . . 0.485 ' HE3' ' CD2' ' A' ' 454' ' ' LEU . 0.5 OUTLIER -64.97 -54.91 23.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.454 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.0 m-85 -60.43 -47.39 86.31 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.025 1.33 . . . . 0.0 108.1 -175.205 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -52.23 -51.93 55.4 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.227 2.211 . . . . 0.0 110.377 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.1 t -51.48 -50.57 59.6 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.482 0.713 . . . . 0.0 111.342 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 474' ' ' LEU . 55.8 mt -66.19 -40.96 90.8 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.722 1.209 . . . . 0.0 111.374 -174.498 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.06 -38.7 92.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.651 1.981 . . . . 0.0 109.201 174.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -49.96 54.65 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.488 1.515 . . . . 0.0 109.766 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 13.6 mt -58.23 -45.96 86.77 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.291 1.436 . . . . 0.0 109.586 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -59.96 -46.76 88.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.068 0.947 . . . . 0.0 109.648 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.84 -47.73 70.65 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.67 -50.07 73.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.396 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -43.63 81.41 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.423 1.889 . . . . 0.0 110.605 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.564 ' HB2' HD21 ' A' ' 571' ' ' LEU . 11.1 mt -59.25 -52.64 64.8 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.696 1.199 . . . . 0.0 109.365 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 33.4 mm -63.62 -34.94 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 121.379 1.899 . . . . 0.0 113.1 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -57.64 -37.5 73.45 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -67.96 2.24 2.18 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 128.593 2.757 . . . . 0.0 112.999 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -94.22 -54.4 3.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 119.809 1.186 . . . . 0.0 111.606 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -72.07 8.57 1.22 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.855 1.262 . . . . 0.0 113.451 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.5 p -124.44 -67.4 0.92 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.11 0.964 . . . . 0.0 110.599 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.59 -68.06 0.82 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.695 1.998 . . . . 0.0 109.181 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 140.02 132.07 2.84 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 126.409 1.957 . . . . 0.0 108.544 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.7 120.47 22.68 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.86 172.93 0.48 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.087 0.946 . . . . 0.0 109.712 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.57 -45.99 90.22 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 121.322 -0.861 . . . . 0.0 109.952 172.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.29 -46.15 67.88 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-O 116.998 -1.477 . . . . 0.0 110.319 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -62.63 -42.71 99.75 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 121.116 1.78 . . . . 0.0 110.262 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -59.48 -37.58 78.59 Favored 'General case' 0 C--N 1.343 0.306 0 O-C-N 120.897 -1.127 . . . . 0.0 110.9 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 39.4 mt -73.48 -39.92 64.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.512 176.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -46.54 56.91 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.649 1.58 . . . . 0.0 107.832 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 554' ' ' LEU . 3.1 mt -55.99 -45.89 78.86 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 174.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -47.73 77.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.661 1.119 . . . . 0.0 108.144 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -32.73 73.33 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 118.943 -0.551 . . . . 0.0 111.093 -178.103 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.74 -37.91 82.81 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.701 1.137 . . . . 0.0 110.347 174.035 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -71.58 -31.3 66.8 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 120.409 -1.432 . . . . 0.0 109.801 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -73.31 -25.41 60.64 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.608 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -78.04 -35.0 50.24 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.854 1.661 . . . . 0.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 N--CA 1.474 0.731 0 C-N-CA 125.801 1.64 . . . . 0.0 111.911 176.08 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 120.972 0.415 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 452' ' ' ARG . . . . . 0.544 ' HD2' HD21 ' A' ' 519' ' ' LEU . 12.6 mmt85 -59.98 -30.41 69.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.021 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 534' ' ' THR . 1.5 mm -63.7 -52.98 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 120.067 1.303 . . . . 0.0 108.162 174.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.87 -52.9 63.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.571 1.078 . . . . 0.0 108.389 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 38.7 mt -66.63 -53.5 34.71 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.082 -176.432 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -55.6 -41.37 81.67 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 128.19 2.805 . . . . 0.0 112.234 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.3 mt -70.92 -36.03 72.51 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 118.073 -0.965 . . . . 0.0 109.399 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -27.97 67.13 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.259 1.391 . . . . 0.0 111.744 173.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.448 ' HA ' HD23 ' A' ' 503' ' ' LEU . 33.6 t -69.24 -56.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 125.089 1.356 . . . . 0.0 107.908 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -75.9 -8.51 57.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.488 ' HB3' HD12 ' A' ' 464' ' ' LEU . 20.4 t-20 -146.96 70.65 12.21 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 121.198 -0.939 . . . . 0.0 111.706 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.52 -17.85 60.32 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.832 1.688 . . . . 0.0 111.446 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.91 -22.87 64.14 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 120.343 -1.473 . . . . 0.0 112.352 173.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.63 HD13 ' CD1' ' A' ' 535' ' ' PHE . 49.3 mt -59.84 -14.99 17.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.531 1.06 . . . . 0.0 109.907 173.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.26 -20.57 66.48 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.743 -0.598 . . . . 0.0 112.299 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 77.4 m -83.96 -26.19 29.44 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 119.387 0.994 . . . . 0.0 110.254 173.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.551 HD12 HD23 ' A' ' 464' ' ' LEU . 28.6 mt -84.98 -14.98 45.81 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.355 -0.84 . . . . 0.0 112.275 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 489' ' ' VAL . 3.0 p -69.41 152.09 96.56 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.18 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.467 ' CD ' HD11 ' A' ' 539' ' ' LEU . 18.1 Cg_endo -73.74 170.63 19.57 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.063 1.842 . . . . 0.0 111.488 173.415 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -74.51 2.28 6.51 Favored 'Trans proline' 0 CA--C 1.541 0.838 1 C-N-CA 125.533 4.155 . . . . 0.0 113.953 173.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.571 HD23 HH11 ' A' ' 486' ' ' ARG . 1.0 OUTLIER 71.09 65.82 0.17 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.92 2.488 . . . . 0.0 110.854 174.441 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -73.23 -72.98 0.23 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.51 1.124 . . . . 0.0 110.206 -173.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.88 13.72 13.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.665 1.186 . . . . 0.0 112.397 176.435 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.511 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.3 OUTLIER -87.14 -85.52 0.17 Allowed 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 -173.498 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.0 t0 62.47 152.13 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 O-C-N 126.384 2.302 . . . . 0.0 111.944 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -84.31 -18.46 36.24 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 118.678 -2.514 . . . . 0.0 108.896 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -78.3 -9.03 59.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.885 1.674 . . . . 0.0 112.95 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -116.74 5.98 13.2 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.569 1.547 . . . . 0.0 111.186 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.666 HD13 ' HG ' ' A' ' 482' ' ' LEU . 0.4 OUTLIER -129.29 163.02 49.02 Favored Pre-proline 0 C--O 1.221 -0.433 0 C-N-CA 126.226 1.81 . . . . 0.0 110.193 -179.051 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -80.89 -67.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 120.867 1.045 . . . . 0.0 112.991 -172.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -128.03 25.06 4.99 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.666 ' HG ' HD13 ' A' ' 479' ' ' LEU . 1.7 tm? -62.47 -31.22 71.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.051 -0.976 . . . . 0.0 108.565 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.09 -38.28 6.09 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-O 118.644 -1.087 . . . . 0.0 111.696 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -55.55 33.33 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.09 1.945 . . . . 0.0 111.728 174.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.53 ' HB3' HD22 ' A' ' 482' ' ' LEU . 81.9 t80 -53.69 -54.78 33.05 Favored 'General case' 0 C--N 1.337 0.029 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.721 174.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.571 HH11 HD23 ' A' ' 471' ' ' LEU . 2.2 ttp85 -55.61 -46.18 77.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.535 0.734 . . . . 0.0 110.973 -173.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.59 -39.01 70.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.837 1.255 . . . . 0.0 110.719 -175.53 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.784 HD11 HD21 ' A' ' 516' ' ' LEU . 2.5 mt -61.16 -46.28 91.16 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 123.282 0.633 . . . . 0.0 109.862 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 468' ' ' VAL . 67.4 t -61.92 -47.85 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-O 118.095 -0.955 . . . . 0.0 108.606 176.251 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -54.38 -47.23 72.91 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.616 1.566 . . . . 0.0 109.982 -177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 89.5 m -63.96 -47.49 80.2 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 126.07 1.748 . . . . 0.0 109.894 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.2 m -60.74 -36.93 80.13 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.213 -2.18 . . . . 0.0 111.923 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.46 -26.82 68.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.939 2.096 . . . . 0.0 111.55 173.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.78 -53.67 7.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.579 1.552 . . . . 0.0 108.345 173.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.06 101.06 0.24 Allowed Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 119.645 1.111 . . . . 0.0 111.883 -175.044 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -63.25 128.73 23.44 Favored 'Trans proline' 0 N--CA 1.439 -1.717 0 N-CA-C 107.329 -1.835 . . . . 0.0 107.329 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.63 48.05 56.7 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 124.374 0.988 . . . . 0.0 113.093 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.601 HD21 HD13 ' A' ' 503' ' ' LEU . 32.6 tp -63.61 155.54 29.39 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.149 0.979 . . . . 0.0 110.272 173.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.0 163.65 29.8 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.568 1.947 . . . . 0.0 108.19 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 86.0 m -51.34 -46.69 62.75 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.182 0.993 . . . . 0.0 110.551 173.733 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.41 -43.89 14.59 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -62.0 -24.2 66.9 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.778 0.831 . . . . 0.0 111.188 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.601 HD13 HD21 ' A' ' 498' ' ' LEU . 24.1 tp -67.09 -51.22 57.04 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 123.876 0.87 . . . . 0.0 110.778 176.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.8 mt -61.18 -34.41 75.01 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 122.76 0.424 . . . . 0.0 110.151 173.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.98 -39.29 90.22 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.466 -0.771 . . . . 0.0 112.318 177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -65.6 -17.84 64.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.615 1.566 . . . . 0.0 112.577 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -117.26 21.37 13.18 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.99 2.116 . . . . 0.0 110.776 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.18 131.2 50.07 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 119.952 -1.718 . . . . 0.0 109.194 -175.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 67.86 31.08 74.93 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 173.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.796 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.9 m -102.31 148.69 25.15 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.74 -21.66 64.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.797 1.239 . . . . 0.0 111.362 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 t-20 -92.6 -15.75 26.49 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.463 1.505 . . . . 0.0 111.58 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.78 -47.57 59.62 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.77 61.59 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.232 1.013 . . . . 0.0 113.28 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 30.0 m -66.48 -48.74 68.89 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.116 0.966 . . . . 0.0 110.382 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.784 HD21 HD11 ' A' ' 488' ' ' LEU . 65.2 mt -57.06 -39.43 74.9 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.351 1.46 . . . . 0.0 111.961 174.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -75.02 -34.3 61.9 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 127.296 2.238 . . . . 0.0 110.923 -177.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -33.98 75.85 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 173.447 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.544 HD21 ' HD2' ' A' ' 452' ' ' ARG . 77.2 mt -78.83 -13.87 59.56 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.953 1.251 . . . . 0.0 114.353 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.5 t -72.86 -60.46 2.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.144 1.378 . . . . 0.0 108.739 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -71.1 0.76 6.92 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.646 1.578 . . . . 0.0 113.973 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.96 111.13 3.18 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 124.257 1.023 . . . . 0.0 111.903 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.53 0.25 47.14 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.59 2.356 . . . . 0.0 110.095 -175.543 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.25 -18.88 60.57 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 125.983 1.713 . . . . 0.0 111.759 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -122.19 -78.58 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 131.26 3.824 . . . . 0.0 109.743 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.3 59.95 4.11 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.151 1.78 . . . . 0.0 111.914 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -153.7 170.78 20.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.853 0.861 . . . . 0.0 110.914 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.22 -32.07 4.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 127.55 2.34 . . . . 0.0 110.911 173.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -84.84 -55.82 3.89 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 120.552 -1.343 . . . . 0.0 109.115 -177.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 63.7 mt -58.05 -27.64 32.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 124.235 1.014 . . . . 0.0 108.56 174.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.91 -59.93 3.62 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 125.168 1.387 . . . . 0.0 109.978 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.28 -42.95 64.16 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.386 0.994 . . . . 0.0 109.75 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -48.65 66.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 534' ' ' THR . . . . . 0.546 ' CG2' HD12 ' A' ' 453' ' ' ILE . 89.3 m -61.96 -32.75 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.79 2.036 . . . . 0.0 108.298 177.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.63 ' CD1' HD13 ' A' ' 464' ' ' LEU . 53.9 t80 -64.68 -58.71 5.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 125.496 1.519 . . . . 0.0 109.839 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -60.0 -43.82 94.95 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.303 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.45 -43.41 68.05 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 120.878 1.672 . . . . 0.0 109.473 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' SER . . . . . 0.404 ' HB2' ' CG2' ' A' ' 453' ' ' ILE . 2.6 t -71.07 -48.23 53.82 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.467 HD11 ' CD ' ' A' ' 469' ' ' PRO . 0.7 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 176.428 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -43.91 96.78 Favored 'General case' 0 C--N 1.355 0.833 0 CA-C-O 117.776 -1.107 . . . . 0.0 108.967 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -67.38 -38.44 84.73 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.458 -1.401 . . . . 0.0 111.285 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -54.57 38.25 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.654 ' HA ' HD12 ' A' ' 546' ' ' LEU . 8.5 m-85 -56.39 -48.23 77.31 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.49 1.916 . . . . 0.0 109.783 178.167 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.19 -50.48 71.09 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 127.15 2.18 . . . . 0.0 110.134 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.0 t -50.84 -41.28 57.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.002 0.921 . . . . 0.0 111.253 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.654 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.8 mt -72.85 -41.66 64.55 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 120.504 -1.372 . . . . 0.0 110.596 -176.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 547' ' ' LEU . 21.9 mt -59.56 -45.07 92.89 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 173.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -63.04 -50.78 69.29 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.008 2.123 . . . . 0.0 110.164 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.71 -44.03 77.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.192 1.797 . . . . 0.0 110.08 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -57.35 -46.89 82.86 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.777 -0.63 . . . . 0.0 109.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -55.36 -47.18 76.15 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.661 1.184 . . . . 0.0 110.457 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.44 -39.4 88.87 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -39.81 93.41 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 124.987 1.315 . . . . 0.0 111.256 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.461 ' HB2' HD21 ' A' ' 571' ' ' LEU . 3.6 mt -60.56 -55.2 36.19 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 571' ' ' LEU . 23.1 mm -60.68 -41.26 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 121.068 1.758 . . . . 0.0 111.199 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -62.74 -15.59 53.9 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 119.985 -1.697 . . . . 0.0 113.134 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -98.43 13.79 30.42 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 129.263 3.025 . . . . 0.0 111.028 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -104.25 -61.78 1.4 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 120.502 1.501 . . . . 0.0 109.736 173.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -63.91 -7.75 9.15 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 79.2 p -113.01 -64.4 1.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.065 2.546 . . . . 0.0 109.05 -173.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -93.42 -64.51 1.08 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.102 2.161 . . . . 0.0 111.023 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 134.52 119.95 2.01 Favored Glycine 0 CA--C 1.529 0.961 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 563' ' ' LEU . 7.1 mt -78.22 131.16 37.03 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.11 171.28 5.79 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.35 -43.89 96.4 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.794 -0.622 . . . . 0.0 110.594 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.49 -54.32 29.97 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 567' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 571' ' ' LEU . 13.6 mm-40 -60.18 -30.53 69.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 O-C-N 119.534 -1.978 . . . . 0.0 115.658 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -68.44 -32.97 73.37 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.641 1.176 . . . . 0.0 109.971 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.42 -38.17 50.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 117.824 -1.084 . . . . 0.0 108.72 174.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.91 -44.22 50.1 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 119.857 1.208 . . . . 0.0 108.256 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 555' ' ' ILE . 1.1 mp -57.79 -44.55 86.37 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.47 175.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -46.8 79.7 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.421 1.464 . . . . 0.0 108.542 177.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -30.33 70.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -39.86 70.87 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.494 1.518 . . . . 0.0 110.016 173.437 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -65.11 -38.91 92.23 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.636 1.574 . . . . 0.0 110.887 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -34.35 77.68 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.11 174.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -32.49 63.62 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 128.228 2.611 . . . . 0.0 111.497 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER . . . . . 0 C--O 1.259 1.572 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 -179.269 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 ptt? . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 65.6 mtt-85 -81.69 -48.06 12.17 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 116.363 -1.779 . . . . 0.0 110.881 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.52 HG23 ' CD1' ' A' ' 457' ' ' LEU . 0.5 OUTLIER -57.64 -49.77 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.081 1.309 . . . . 0.0 109.514 -177.182 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.61 -41.97 64.16 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.661 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 96.7 mt -73.52 -53.49 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 119.498 1.044 . . . . 0.0 112.195 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.95 -29.08 72.53 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 119.74 1.155 . . . . 0.0 113.737 -173.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 525' ' ' ILE . 40.5 mt -70.91 -43.12 68.95 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.571 1.186 . . . . 0.0 108.73 174.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.57 -35.19 77.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.488 1.515 . . . . 0.0 110.765 174.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.28 -47.05 95.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.29 -0.881 . . . . 0.0 110.245 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -83.09 -14.38 53.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.522 0.729 . . . . 0.0 110.822 -174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.425 ' HB3' HD12 ' A' ' 464' ' ' LEU . 55.6 t-20 -145.09 78.6 12.33 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.511 1.924 . . . . 0.0 111.403 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.72 -20.01 64.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 121.019 1.146 . . . . 0.0 113.331 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.56 -15.95 59.45 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.137 1.335 . . . . 0.0 111.109 174.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.425 HD12 ' HB3' ' A' ' 461' ' ' ASN . 45.3 mt -63.4 -15.76 58.52 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 121.022 -1.048 . . . . 0.0 109.942 173.255 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -63.72 -25.22 68.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.932 0.787 . . . . 0.0 110.831 173.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 63.4 m -83.54 -17.4 41.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 0.999 . . . . 0.0 111.881 174.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.4 mt -94.34 -5.59 46.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 111.98 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 489' ' ' VAL . 7.1 p -82.95 144.81 48.39 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 120.662 1.574 . . . . 0.0 108.691 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.66 164.38 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.586 2.857 . . . . 0.0 111.461 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -67.57 12.87 0.18 Allowed 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 124.232 3.288 . . . . 0.0 114.445 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.319 1.7 mp 80.67 8.34 1.27 Allowed 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 129.207 3.003 . . . . 0.0 115.664 173.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -33.33 -55.2 0.42 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.188 2.995 . . . . 0.0 115.01 -174.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.09 -5.53 21.99 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.757 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.446 HD21 ' CE1' ' A' ' 543' ' ' PHE . 45.6 mt -71.21 -86.29 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.561 1.544 . . . . 0.0 110.887 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . 0.276 24.2 t0 58.96 140.97 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.946 3.298 . . . . 0.0 111.696 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -65.64 -29.91 70.55 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.234 1.814 . . . . 0.0 110.285 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -63.59 -24.2 67.7 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.764 1.165 . . . . 0.0 112.431 174.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -92.43 -17.23 24.86 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 120.934 1.697 . . . . 0.0 112.077 176.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.47 ' HG ' HD21 ' A' ' 546' ' ' LEU . 7.1 mt -128.32 86.32 58.18 Favored Pre-proline 0 CA--C 1.515 -0.378 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.76 90.15 0.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.057 1.838 . . . . 0.0 110.058 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 134.17 -16.18 4.44 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.537 2.018 . . . . 0.0 113.156 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 479' ' ' LEU . 4.6 tp -58.19 -24.43 59.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.326 2.063 . . . . 0.0 110.277 173.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.6 -41.49 12.84 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 118.689 0.677 . . . . 0.0 111.875 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -40.79 94.09 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.148 1.474 . . . . 0.0 111.363 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -65.07 -53.03 52.01 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.89 1.276 . . . . 0.0 109.776 173.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -41.56 99.49 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.524 0.73 . . . . 0.0 111.127 -173.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.79 -44.0 82.43 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.815 0.846 . . . . 0.0 109.542 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.602 HD11 HD21 ' A' ' 516' ' ' LEU . 3.4 mt -54.8 -51.46 65.73 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.966 0.506 . . . . 0.0 111.023 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 468' ' ' VAL . 55.4 t -56.81 -47.65 82.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 125.097 1.359 . . . . 0.0 109.924 175.797 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -55.46 -45.08 76.92 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.473 1.509 . . . . 0.0 110.079 179.244 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.3 m -65.41 -40.19 93.07 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.791 1.636 . . . . 0.0 111.263 174.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.8 m -64.85 -44.27 90.3 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 120.022 1.283 . . . . 0.0 110.397 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.24 -20.67 59.88 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.097 1.359 . . . . 0.0 112.815 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 16.8 t -93.43 -37.42 11.97 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.381 1.872 . . . . 0.0 111.367 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -76.76 105.79 2.75 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.95 1.3 . . . . 0.0 110.065 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.64 115.05 4.2 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.792 1.661 . . . . 0.0 110.94 -173.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.54 36.92 47.75 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.38 155.47 11.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.006 0.922 . . . . 0.0 110.542 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 10.8 p -139.87 174.09 10.87 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.2 m -55.95 -50.04 71.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.644 0.777 . . . . 0.0 109.859 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.08 -43.57 47.95 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -174.589 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -66.34 -24.52 66.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.347 1.059 . . . . 0.0 110.585 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.47 -52.47 61.24 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 119.609 1.095 . . . . 0.0 109.035 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.83 -38.77 89.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 118.551 -0.738 . . . . 0.0 109.919 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.66 -40.98 98.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.404 0.682 . . . . 0.0 110.709 177.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.59 -20.49 63.64 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.152 -0.968 . . . . 0.0 112.713 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -106.61 14.36 27.09 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.392 1.077 . . . . 0.0 109.004 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -58.59 119.93 7.94 Favored 'General case' 0 CA--C 1.528 0.118 0 O-C-N 119.801 -1.812 . . . . 0.0 111.41 -174.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.9 15.98 66.35 Favored Glycine 0 CA--C 1.527 0.783 0 CA-C-O 119.176 -0.791 . . . . 0.0 113.012 177.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.842 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.3 m -98.17 153.07 18.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -173.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -60.19 -20.35 58.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.225 -0.922 . . . . 0.0 112.039 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.842 ' H ' HG22 ' A' ' 510' ' ' THR . 76.5 m-20 -89.83 -19.31 24.81 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.128 1.771 . . . . 0.0 110.519 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.61 -51.13 58.09 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 124.473 1.109 . . . . 0.0 110.213 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.92 -44.18 60.08 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.942 0.897 . . . . 0.0 112.321 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 53.0 m -62.24 -50.41 71.84 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.884 174.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.602 HD21 HD11 ' A' ' 488' ' ' LEU . 21.9 mt -60.09 -39.15 85.12 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.555 1.07 . . . . 0.0 111.534 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.94 -45.79 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.807 2.043 . . . . 0.0 109.381 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -61.42 -29.86 70.2 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.335 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 73.8 mt -88.41 -6.37 57.71 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.782 1.233 . . . . 0.0 112.168 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.9 t -83.24 -50.29 8.56 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 126.46 1.904 . . . . 0.0 109.081 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.92 9.37 6.56 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.879 1.271 . . . . 0.0 113.1 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -76.58 78.23 3.26 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.942 1.697 . . . . 0.0 113.448 -172.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.55 -0.78 0.07 Allowed 'General case' 0 CA--C 1.534 0.33 1 C-N-CA 131.797 4.039 . . . . 0.0 113.526 174.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.7 -26.92 36.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.044 2.138 . . . . 0.0 111.49 174.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -112.73 -50.69 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 125.84 1.656 . . . . 0.0 110.72 175.1 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 42.97 47.19 4.9 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.571 1.948 . . . . 0.0 113.306 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.0 173.01 16.57 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 174.345 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -131.28 -19.96 2.74 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 127.19 2.196 . . . . 0.0 111.809 177.677 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.88 -56.13 3.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.211 2.204 . . . . 0.0 106.902 173.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 65.2 mt -59.06 -28.33 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.087 0.555 . . . . 0.0 109.75 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.11 -40.15 67.04 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.564 1.145 . . . . 0.0 111.937 176.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -49.97 65.78 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.362 0.983 . . . . 0.0 109.588 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -62.31 -46.57 88.13 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.768 0.427 . . . . 0.0 110.448 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.7 m -66.29 -30.64 71.11 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.604 1.161 . . . . 0.0 110.253 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -69.7 -46.14 66.66 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 119.632 1.106 . . . . 0.0 108.985 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 56.7 m -61.25 -41.08 96.28 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.273 0.488 . . . . 0.0 110.315 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.6 -47.46 86.1 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.997 0.919 . . . . 0.0 111.074 174.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 20.5 t -63.7 -44.9 92.28 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.156 -0.965 . . . . 0.0 111.963 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.02 -50.92 69.56 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.44 -0.79 . . . . 0.0 109.74 175.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -54.77 -44.52 73.77 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.12 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -66.7 -35.57 80.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 119.868 1.213 . . . . 0.0 111.044 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -49.12 71.28 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 174.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.446 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.3 m-85 -64.18 -47.09 81.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.687 0.676 . . . . 0.0 111.303 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.75 -49.05 69.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.419 2.687 . . . . 0.0 108.53 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 23.2 t -58.68 -42.66 89.02 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.708 -0.62 . . . . 0.0 111.48 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.47 HD21 ' HG ' ' A' ' 479' ' ' LEU . 60.2 mt -71.61 -32.33 67.89 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 119.165 0.893 . . . . 0.0 110.155 -175.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.7 mt -70.85 -41.05 71.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.618 0.767 . . . . 0.0 109.118 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.29 -50.58 71.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.002 0.921 . . . . 0.0 109.184 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 51.7 mt -57.83 -39.06 76.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.206 1.003 . . . . 0.0 110.448 174.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -61.84 -42.94 99.66 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 118.103 -0.951 . . . . 0.0 108.771 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -61.61 -41.34 97.33 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 116.108 -1.901 . . . . 0.0 110.368 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.37 -46.0 90.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.177 2.262 . . . . 0.0 109.811 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -63.17 -39.09 93.64 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -174.607 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.58 -51.46 42.33 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.956 1.302 . . . . 0.0 111.388 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.8 mm -64.16 -36.62 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 119.536 1.062 . . . . 0.0 109.123 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.45 -33.61 75.94 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.335 -1.478 . . . . 0.0 111.48 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 52.0 mtt-85 -61.14 -32.43 72.13 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 116.331 -1.795 . . . . 0.0 109.323 173.912 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -57.22 -42.29 81.08 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 121.402 1.91 . . . . 0.0 110.527 176.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.94 3.65 7.9 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -177.187 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.497 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.92 -85.89 0.09 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.417 1.008 . . . . 0.0 108.934 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.497 ' H ' HG23 ' A' ' 560' ' ' THR . 3.2 m-70 -47.4 -41.32 19.71 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.994 2.118 . . . . 0.0 113.558 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.8 101.16 1.21 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.15 132.61 54.54 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 173.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 170.58 13.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 122.918 1.342 . . . . 0.0 109.249 176.225 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -40.02 94.86 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.804 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -46.63 60.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.706 1.879 . . . . 0.0 109.124 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -65.39 -35.27 80.44 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.517 1.053 . . . . 0.0 111.598 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.4 ' HA ' HD12 ' A' ' 571' ' ' LEU . 9.7 ttm180 -63.01 -31.75 72.96 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 120.595 -1.315 . . . . 0.0 109.472 174.611 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 5.0 mp -78.23 -32.3 49.71 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.458 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.49 -43.38 84.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.699 1.59 . . . . 0.0 107.671 173.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 568' ' ' ARG . 3.4 mt -58.22 -39.84 80.08 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-O 116.481 -1.723 . . . . 0.0 113.269 175.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -62.38 -40.68 97.26 Favored 'General case' 0 C--N 1.345 0.413 0 CA-C-N 122.383 2.356 . . . . 0.0 109.095 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -41.63 76.55 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -40.21 87.6 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.595 -1.315 . . . . 0.0 110.77 174.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -57.93 -42.98 86.0 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.758 1.223 . . . . 0.0 110.331 174.031 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.43 -27.8 52.36 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.295 1.407 . . . . 0.0 111.375 -176.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.47 -42.29 83.22 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 22.8 mt . . . . . 0 C--O 1.218 -0.593 0 CA-C-N 118.7 0.682 . . . . 0.0 110.887 -178.909 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 17.5 ptt? . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.7 mmm-85 -59.75 -39.68 85.58 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-O 118.179 -0.915 . . . . 0.0 109.61 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 mm -67.98 -43.83 85.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.147 0 CA-C-O 115.146 -2.359 . . . . 0.0 108.873 176.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.631 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 2.9 mm? -59.05 -54.51 46.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.47 1.941 . . . . 0.0 108.694 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.436 HG23 HD13 ' A' ' 488' ' ' LEU . 25.6 mt -59.97 -59.63 3.74 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 124.266 1.026 . . . . 0.0 111.098 177.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.36 -29.32 71.17 Favored Glycine 0 N--CA 1.468 0.787 0 CA-C-N 120.847 1.658 . . . . 0.0 113.551 -173.599 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.589 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.1 OUTLIER -71.34 -45.89 61.87 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.457 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.44 -32.12 73.47 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 127.415 2.286 . . . . 0.0 110.83 175.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 503' ' ' LEU . 18.6 t -66.67 -55.08 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 124.654 1.182 . . . . 0.0 108.201 174.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 460' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 500' ' ' THR . 76.5 mt-30 -72.2 -17.73 61.91 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 118.707 -0.663 . . . . 0.0 112.461 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.448 ' HB3' HD12 ' A' ' 464' ' ' LEU . 53.0 t-20 -146.29 80.62 10.01 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 127.164 2.186 . . . . 0.0 110.68 -174.246 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.6 -20.92 34.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.207 1.938 . . . . 0.0 112.296 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -66.92 -18.92 65.61 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.929 0.892 . . . . 0.0 110.039 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 461' ' ' ASN . 43.9 mt -63.85 -12.09 33.27 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.953 1.706 . . . . 0.0 110.179 173.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.94 87.93 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 119.015 0.825 . . . . 0.0 109.818 173.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 61.3 m -69.21 -13.28 62.32 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.899 0.772 . . . . 0.0 111.967 174.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.71 -15.91 20.16 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.403 1.002 . . . . 0.0 112.573 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -80.26 146.49 62.47 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.87 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -74.33 169.06 23.35 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.829 3.019 . . . . 0.0 112.072 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.83 0.51 5.59 Favored 'Trans proline' 0 CA--C 1.552 1.381 0 C-N-CA 122.703 2.269 . . . . 0.0 114.819 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.879 HD22 HD11 ' A' ' 482' ' ' LEU 0.286 1.2 mp 76.04 39.92 0.28 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 130.063 3.345 . . . . 0.0 115.816 177.225 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.68 -51.55 48.33 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.299 1.44 . . . . 0.0 114.108 -178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.72 2.49 19.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.004 -1.685 . . . . 0.0 111.732 174.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.53 HD21 ' CE1' ' A' ' 543' ' ' PHE . 5.8 mp -112.4 -74.29 0.64 Allowed 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 123.375 0.67 . . . . 0.0 111.083 -173.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 5.9 t70 60.06 169.24 0.08 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.928 1.823 . . . . 0.0 110.348 -173.078 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -84.23 -24.4 30.05 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 125.823 1.649 . . . . 0.0 108.886 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -56.12 -48.43 76.22 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 126.397 1.879 . . . . 0.0 108.609 173.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -74.81 -32.04 61.87 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 119.012 -1.075 . . . . 0.0 111.99 -174.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.42 ' CD1' HD21 ' A' ' 546' ' ' LEU . 17.0 mt -131.09 115.92 16.61 Favored Pre-proline 0 C--O 1.225 -0.214 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -173.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.25 -51.47 0.34 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 CA-C-N 120.67 1.275 . . . . 0.0 111.739 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -67.08 -19.9 70.44 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.862 1.22 . . . . 0.0 112.207 -177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.879 HD11 HD22 ' A' ' 471' ' ' LEU . 1.4 tm? -61.15 -33.5 73.51 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.567 1.547 . . . . 0.0 110.418 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.35 -47.86 6.9 Favored Glycine 0 CA--C 1.527 0.814 0 O-C-N 123.833 0.708 . . . . 0.0 111.844 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -41.35 91.03 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.133 0.973 . . . . 0.0 112.315 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.631 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 41.2 t80 -66.81 -51.17 58.88 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.578 1.535 . . . . 0.0 109.777 174.328 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -55.63 -47.31 76.82 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 118.449 0.568 . . . . 0.0 111.0 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.48 -39.99 92.59 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.891 0.876 . . . . 0.0 110.792 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.477 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -64.06 -47.6 79.53 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.85 1.26 . . . . 0.0 112.484 174.472 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 468' ' ' VAL . 49.4 t -59.0 -49.45 83.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.465 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -55.33 -44.11 75.59 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.662 1.185 . . . . 0.0 108.944 -176.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 55.0 m -63.01 -43.86 97.59 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.671 2.389 . . . . 0.0 111.837 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.6 m -63.6 -44.06 95.11 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.251 0.932 . . . . 0.0 109.457 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -16.99 64.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.71 1.204 . . . . 0.0 111.229 173.479 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.68 -16.44 26.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.753 1.221 . . . . 0.0 112.293 176.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -122.26 82.45 45.48 Favored Pre-proline 0 CA--C 1.536 0.427 0 C-N-CA 124.848 1.259 . . . . 0.0 107.796 175.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -63.57 139.38 69.72 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 N-CA-C 108.114 -1.533 . . . . 0.0 108.114 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 78.69 15.45 80.76 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 118.394 -1.225 . . . . 0.0 113.996 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.05 166.4 4.73 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 120.079 1.939 . . . . 0.0 109.183 173.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.7 p -140.93 163.01 34.12 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 119.569 -1.957 . . . . 0.0 108.982 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.493 HG23 ' HA ' ' A' ' 460' ' ' GLN . 7.4 m -47.63 -41.72 22.68 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.333 1.453 . . . . 0.0 112.469 174.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -85.02 -50.38 4.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -58.0 -24.19 57.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.007 1.723 . . . . 0.0 112.119 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 459' ' ' VAL . 59.1 tp -58.6 -48.29 81.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.657 1.117 . . . . 0.0 108.865 173.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.46 -29.39 68.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.847 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.93 -43.78 78.37 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.615 0.766 . . . . 0.0 109.991 174.385 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.26 -21.13 61.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.77 1.168 . . . . 0.0 112.868 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -111.53 11.84 21.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.908 0.883 . . . . 0.0 110.163 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.76 126.59 24.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 120.477 -1.39 . . . . 0.0 110.832 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.97 15.39 81.22 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 118.704 -1.053 . . . . 0.0 114.501 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.753 HG22 ' H ' ' A' ' 512' ' ' ASN . 75.2 m -93.1 148.23 22.18 Favored 'General case' 0 C--O 1.246 0.893 0 CA-C-N 119.222 1.511 . . . . 0.0 108.083 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -58.29 -25.34 61.7 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.172 -0.955 . . . . 0.0 111.134 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.753 ' H ' HG22 ' A' ' 510' ' ' THR . 0.7 OUTLIER -89.61 -17.94 27.5 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.278 2.231 . . . . 0.0 112.183 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.87 -49.42 62.95 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.917 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.36 -43.79 54.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.338 0.972 . . . . 0.0 112.567 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 78.9 m -60.58 -51.33 69.88 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.477 HD21 HD11 ' A' ' 488' ' ' LEU . 76.4 mt -57.13 -44.57 83.45 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 125.541 1.536 . . . . 0.0 112.512 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.53 -39.62 88.7 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.641 1.976 . . . . 0.0 109.137 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -37.46 84.71 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 78.7 mt -82.72 -9.53 59.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.641 0.776 . . . . 0.0 112.315 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.8 t -76.24 -59.88 2.57 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 0.0 107.583 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.35 22.58 0.67 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.784 2.034 . . . . 0.0 112.777 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.5 t90 -73.03 114.71 11.49 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -173.242 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.17 7.95 43.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 128.413 2.685 . . . . 0.0 114.595 -173.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -70.89 -40.0 72.48 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.441 -1.412 . . . . 0.0 109.13 173.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.589 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.3 pt -108.38 -70.67 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 127.361 2.264 . . . . 0.0 110.73 -174.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.12 37.79 11.57 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.76 2.024 . . . . 0.0 114.798 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -129.36 -178.74 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.5 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -137.07 -24.68 1.1 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.151 2.18 . . . . 0.0 112.301 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -91.18 -54.79 3.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.007 2.123 . . . . 0.0 108.073 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -62.35 -22.02 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.54 -52.75 63.59 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.279 1.4 . . . . 0.0 111.46 174.166 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -62.34 -42.21 99.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.301 1.41 . . . . 0.0 110.68 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -53.32 51.91 Favored 'General case' 0 C--N 1.34 0.184 0 O-C-N 122.025 -0.422 . . . . 0.0 111.079 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 33.5 m -61.26 -33.77 74.08 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.236 -1.364 . . . . 0.0 110.664 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.48 ' HB2' HD12 ' A' ' 457' ' ' LEU . 41.4 t80 -64.23 -49.32 72.42 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 121.242 1.837 . . . . 0.0 109.786 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.3 m -62.41 -45.31 93.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.411 1.084 . . . . 0.0 111.159 178.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.87 -43.79 98.13 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.12 1.368 . . . . 0.0 110.694 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 6.0 t -67.56 -45.9 74.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 124.319 1.048 . . . . 0.0 112.616 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.0 tt -54.92 -51.74 65.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -55.52 -44.53 76.75 Favored 'General case' 0 C--O 1.205 -1.245 0 C-N-CA 124.754 1.221 . . . . 0.0 111.327 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -63.3 -38.88 92.9 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.051 0.841 . . . . 0.0 112.053 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.3 -51.42 68.96 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.889 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.537 ' HA ' HD12 ' A' ' 546' ' ' LEU . 2.5 m-85 -58.1 -48.35 80.45 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.849 0.86 . . . . 0.0 111.406 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -57.52 -41.44 80.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.721 2.009 . . . . 0.0 109.495 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.5 t -56.73 -36.58 69.89 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.711 -1.243 . . . . 0.0 112.455 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 543' ' ' PHE . 14.1 mt -81.99 -35.59 28.78 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 124.747 1.219 . . . . 0.0 109.284 -176.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -40.81 91.61 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.218 1.407 . . . . 0.0 108.766 174.152 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -59.68 -55.68 31.31 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.718 1.607 . . . . 0.0 108.429 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 18.5 mt -52.61 -47.58 66.87 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.491 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -64.36 -44.07 92.57 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.86 1.209 . . . . 0.0 110.128 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.33 -49.29 67.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.154 0.982 . . . . 0.0 108.88 173.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.27 -40.68 86.18 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.176 0.444 . . . . 0.0 110.336 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -54.78 -48.28 72.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.917 1.287 . . . . 0.0 108.969 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.412 ' HB2' HD21 ' A' ' 571' ' ' LEU . 5.1 mt -61.86 -52.73 62.92 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.685 1.594 . . . . 0.0 110.066 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.8 mm -63.69 -35.95 74.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 121.88 2.127 . . . . 0.0 111.239 177.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.88 73.19 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 120.964 -1.085 . . . . 0.0 109.81 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 15.5 mtm180 -92.39 -3.64 54.99 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 116.724 -1.608 . . . . 0.0 111.223 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.47 -60.87 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 122.718 2.508 . . . . 0.0 105.151 173.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -14.52 62.84 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -173.342 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 62.2 p -114.01 -61.42 1.75 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 120.81 1.641 . . . . 0.0 109.631 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -82.25 -35.79 27.8 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.068 1.347 . . . . 0.0 113.733 -175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 77.42 80.47 0.66 Allowed Glycine 0 C--N 1.338 0.688 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 -173.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 167.1 1.54 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 173.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 8.4 t -70.19 157.89 36.81 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 120.29 -1.506 . . . . 0.0 108.949 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -38.36 75.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.27 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -63.31 -51.86 64.28 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.322 1.049 . . . . 0.0 111.094 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -53.75 -40.88 66.55 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.534 1.061 . . . . 0.0 111.361 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' A' ' 571' ' ' LEU . 4.5 tmt_? -60.93 -39.37 89.19 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.392 -1.443 . . . . 0.0 109.981 176.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 7.7 mp -72.79 -33.96 66.61 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 116.937 -1.506 . . . . 0.0 110.962 175.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.63 -43.74 62.7 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.446 1.475 . . . . 0.0 108.967 174.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' A' ' 568' ' ' ARG . 1.6 mt -57.06 -39.22 74.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -41.24 92.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 121.442 1.928 . . . . 0.0 108.157 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -35.48 80.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 122.442 0.297 . . . . 0.0 111.369 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.05 -41.35 70.9 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.578 -1.326 . . . . 0.0 109.99 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -60.24 -37.64 81.01 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.992 -1.067 . . . . 0.0 111.246 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -71.54 -32.81 68.56 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.594 1.088 . . . . 0.0 111.019 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -66.74 -40.69 88.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.08 0.952 . . . . 0.0 110.318 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 CA--C 1.549 0.928 0 O-C-N 121.147 -0.97 . . . . 0.0 108.791 -176.902 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -120.53 -42.92 2.52 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.888 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 4.8 mm -68.94 -52.22 36.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.642 0 CA-C-O 117.6 -1.19 . . . . 0.0 108.788 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.1 mt -54.23 -50.17 67.76 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 120.405 1.457 . . . . 0.0 110.595 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.468 HG22 ' HG ' ' A' ' 519' ' ' LEU . 81.9 mt -64.58 -55.6 20.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.163 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.98 -44.1 92.88 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 120.045 1.293 . . . . 0.0 112.815 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.675 HD21 HG21 ' A' ' 525' ' ' ILE . 50.9 mt -65.26 -50.28 66.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.459 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.82 -34.42 74.51 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.963 0.801 . . . . 0.0 111.744 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.64 -48.85 84.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 120.899 -1.125 . . . . 0.0 109.679 175.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -79.12 -17.11 55.67 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.918 -0.489 . . . . 0.0 111.685 175.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.563 ' HB3' HD12 ' A' ' 464' ' ' LEU . 24.9 t-20 -131.42 70.96 81.78 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-N 119.637 1.108 . . . . 0.0 109.198 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.85 -18.89 53.06 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.704 1.603 . . . . 0.0 111.576 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -67.45 -23.0 65.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.925 0.89 . . . . 0.0 110.605 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 461' ' ' ASN . 63.2 mt -62.12 -12.51 19.89 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 120.867 -1.145 . . . . 0.0 110.356 173.694 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -59.7 -39.79 85.74 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.946 1.248 . . . . 0.0 111.673 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 53.6 m -77.17 -13.96 59.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 120.163 1.347 . . . . 0.0 111.993 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.3 mt -90.73 -19.27 23.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.356 1.063 . . . . 0.0 112.516 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -81.77 149.21 63.34 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.851 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 468' ' ' VAL . 17.0 Cg_endo -69.36 173.99 9.81 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.142 3.228 . . . . 0.0 112.08 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -75.06 5.21 4.15 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 124.046 3.164 . . . . 0.0 114.048 175.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.904 HD23 HD21 ' A' ' 482' ' ' LEU . 7.1 mp 67.62 53.61 0.7 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.954 2.502 . . . . 0.0 111.675 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.51 -65.66 0.9 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.95 1.3 . . . . 0.0 108.95 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.3 -12.17 60.62 Favored 'General case' 0 C--N 1.344 0.369 0 O-C-N 120.969 -1.082 . . . . 0.0 111.775 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.665 HD12 ' HG ' ' A' ' 471' ' ' LEU . 22.4 mt -82.49 -77.14 0.24 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.2 t0 65.83 150.87 0.05 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.064 1.746 . . . . 0.0 111.999 -174.242 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.2 -10.01 59.14 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 120.325 -1.484 . . . . 0.0 111.313 178.258 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -82.09 -37.39 26.41 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.141 0.976 . . . . 0.0 111.102 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -85.23 -29.51 24.6 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 118.508 -0.758 . . . . 0.0 110.414 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.623 HD21 HD11 ' A' ' 546' ' ' LEU . 3.6 mm? -116.16 89.44 25.6 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.475 1.11 . . . . 0.0 109.138 -174.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.9 87.04 0.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.293 3.328 . . . . 0.0 110.146 -176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 135.09 -15.57 4.25 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.767 1.651 . . . . 0.0 112.86 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.904 HD21 HD23 ' A' ' 471' ' ' LEU . 0.9 OUTLIER -64.05 -25.95 68.34 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-O 116.968 -1.492 . . . . 0.0 110.962 173.827 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.99 -40.47 12.72 Favored Glycine 0 C--O 1.218 -0.866 0 CA-C-N 119.68 1.127 . . . . 0.0 111.39 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 35.2 tp -61.33 -43.02 99.58 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.82 1.31 . . . . 0.0 112.504 176.53 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -66.34 -47.59 73.0 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.35 1.06 . . . . 0.0 110.527 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.537 ' HG3' HD22 ' A' ' 471' ' ' LEU . 65.6 ttt-85 -58.73 -51.13 71.28 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.197 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -43.31 99.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 123.83 0.707 . . . . 0.0 110.297 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.434 HD13 HG23 ' A' ' 455' ' ' ILE . 0.9 OUTLIER -57.82 -49.01 78.08 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 123.56 0.744 . . . . 0.0 111.609 179.143 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.67 HG11 ' CG1' ' A' ' 468' ' ' VAL . 71.9 t -62.35 -48.19 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.238 175.189 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -53.65 -45.76 70.33 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.907 1.683 . . . . 0.0 108.558 -176.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 3.0 m -66.47 -45.73 78.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.401 1.88 . . . . 0.0 110.359 173.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 87.5 m -57.88 -40.3 79.93 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 121.352 1.887 . . . . 0.0 112.065 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.7 -24.5 67.59 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.36 1.464 . . . . 0.0 111.774 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -49.72 12.85 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.363 0.665 . . . . 0.0 110.172 174.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -73.84 102.45 0.62 Allowed Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 124.291 1.036 . . . . 0.0 110.584 -173.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.41 124.35 11.95 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 109.626 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.73 41.98 99.76 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 123.853 0.74 . . . . 0.0 111.379 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 24.9 tp -61.13 156.17 18.84 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.528 0.68 . . . . 0.0 110.083 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.57 165.42 21.75 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.0 m -54.52 -43.25 71.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.448 1.499 . . . . 0.0 110.943 176.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -78.3 -39.14 23.63 Favored Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.42 -26.81 68.14 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.084 0.553 . . . . 0.0 111.849 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 38.2 tp -60.12 -52.68 64.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.615 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.0 mm? -65.11 -31.44 72.64 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 122.053 -0.404 . . . . 0.0 111.745 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -44.12 79.14 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.321 1.048 . . . . 0.0 110.442 175.446 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -61.16 -17.31 52.3 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.833 -1.167 . . . . 0.0 112.714 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -113.73 16.29 18.57 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.785 2.034 . . . . 0.0 110.141 177.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -58.44 133.21 55.57 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 119.837 -1.789 . . . . 0.0 109.149 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 69.93 27.97 72.43 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.038 -0.413 . . . . 0.0 112.581 173.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.774 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.6 m -108.14 145.91 33.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -61.72 -12.04 14.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.794 1.237 . . . . 0.0 112.062 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.774 ' H ' HG22 ' A' ' 510' ' ' THR . 4.8 m120 -107.55 -14.13 14.91 Favored 'General case' 0 C--N 1.372 1.555 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 -174.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -48.82 -51.33 30.02 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 120.394 1.452 . . . . 0.0 110.021 172.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.42 -43.26 54.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.374 1.47 . . . . 0.0 113.534 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 17.5 m -64.86 -54.07 36.83 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.417 HD21 HD11 ' A' ' 488' ' ' LEU . 9.6 mt -56.1 -34.2 65.8 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 124.278 1.031 . . . . 0.0 111.684 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.37 -39.95 92.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 126.417 1.887 . . . . 0.0 107.853 176.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -63.44 -29.74 70.97 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.126 1.33 . . . . 0.0 112.114 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.468 ' HG ' HG22 ' A' ' 455' ' ' ILE . 3.5 mm? -86.84 -41.82 13.74 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 125.954 1.702 . . . . 0.0 110.874 177.014 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 520' ' ' SER . . . . . 0.615 ' HB2' HD21 ' A' ' 504' ' ' LEU . 14.5 t -61.29 -49.84 75.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.508 1.123 . . . . 0.0 110.323 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -71.9 -7.59 49.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 126.198 1.799 . . . . 0.0 112.729 175.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -72.89 131.21 41.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.46 14.86 7.13 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.062 1.745 . . . . 0.0 109.506 -173.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -61.23 -24.99 66.76 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.042 1.737 . . . . 0.0 110.464 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.675 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -99.1 -59.45 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 128.564 2.746 . . . . 0.0 109.403 175.279 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.37 30.54 1.58 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.253 2.221 . . . . 0.0 112.656 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -140.41 165.52 27.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.672 1.189 . . . . 0.0 108.847 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -126.52 -30.42 2.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.628 2.371 . . . . 0.0 111.142 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -79.83 -57.03 3.85 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.737 1.615 . . . . 0.0 107.74 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 51.3 mt -59.72 -28.87 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.523 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.79 -58.85 6.55 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.869 -1.062 . . . . 0.0 109.426 173.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.54 -42.72 75.0 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 120.387 1.449 . . . . 0.0 110.777 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -63.6 -55.19 25.66 Favored 'General case' 0 C--O 1.22 -0.456 0 O-C-N 121.85 -0.532 . . . . 0.0 110.303 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 98.3 m -64.02 -26.9 68.77 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.258 1.423 . . . . 0.0 110.239 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.427 ' CG ' HD13 ' A' ' 464' ' ' LEU . 86.4 t80 -64.42 -59.08 4.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.582 1.083 . . . . 0.0 109.151 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 55.8 m -60.56 -44.92 95.63 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.771 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.05 -44.71 94.48 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.667 1.121 . . . . 0.0 110.777 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 25.7 t -66.16 -49.81 66.11 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.799 2.04 . . . . 0.0 110.556 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.31 -53.6 42.19 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 123.839 0.856 . . . . 0.0 110.76 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.323 1.2 m-20 -64.25 -30.92 71.95 Favored 'General case' 0 N--CA 1.418 -2.045 0 C-N-CA 118.236 -1.385 . . . . 0.0 110.436 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -70.64 -31.56 68.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.148 1.34 . . . . 0.0 110.717 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -55.69 9.53 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.556 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.8 m-85 -56.39 -48.17 77.43 Favored 'General case' 0 C--N 1.347 0.463 0 C-N-CA 123.727 0.811 . . . . 0.0 109.568 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.5 -46.22 90.92 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.269 2.228 . . . . 0.0 110.655 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 34.9 t -51.56 -45.54 63.1 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.03 -0.419 . . . . 0.0 110.132 174.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.623 HD11 HD21 ' A' ' 479' ' ' LEU . 12.0 mt -74.0 -38.95 63.94 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.173 -176.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -47.0 87.11 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.78 -50.54 71.94 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.328 1.451 . . . . 0.0 110.974 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.61 -46.88 87.94 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.296 1.038 . . . . 0.0 109.834 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' ARG . . . . . 0.408 ' O ' HD12 ' A' ' 554' ' ' LEU . 1.5 ttm-85 -64.48 -45.84 85.63 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.518 1.127 . . . . 0.0 109.25 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.05 -53.31 52.13 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.538 1.135 . . . . 0.0 109.333 175.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -58.61 -43.91 89.78 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 117.445 -1.264 . . . . 0.0 110.097 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -50.14 74.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.723 1.209 . . . . 0.0 110.037 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.743 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.6 mt -58.37 -53.33 59.53 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.073 1.349 . . . . 0.0 108.527 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.7 mm -65.02 -39.65 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.344 1.058 . . . . 0.0 110.891 -178.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.01 -33.11 72.75 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.146 2.178 . . . . 0.0 108.258 176.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.36 -2.27 58.5 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 116.143 -1.884 . . . . 0.0 110.8 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -89.41 -44.81 9.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 122.757 2.526 . . . . 0.0 109.622 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -68.63 -3.34 11.54 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 120.603 -1.311 . . . . 0.0 114.099 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.6 OUTLIER -138.65 -87.98 0.23 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 119.469 1.031 . . . . 0.0 109.071 -175.376 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.645 ' H ' HG23 ' A' ' 560' ' ' THR . 8.6 m-70 -55.77 -27.58 51.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.536 1.934 . . . . 0.0 113.385 -178.411 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 61.37 83.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 126.499 1.999 . . . . 0.0 109.575 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.53 160.63 0.16 Allowed 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.073 0.949 . . . . 0.0 109.942 173.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.68 163.14 11.95 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.252 -1.379 . . . . 0.0 111.028 -176.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -55.04 -42.23 72.38 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.171 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.95 -50.33 69.06 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 124.806 1.242 . . . . 0.0 110.922 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -56.89 -38.62 73.04 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.174 1.352 . . . . 0.0 111.842 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.592 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -67.73 -38.84 84.08 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.83 -1.169 . . . . 0.0 109.748 176.544 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.06 -37.25 85.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.999 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.43 -43.08 75.01 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 124.708 1.203 . . . . 0.0 107.765 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 554' ' ' LEU . 3.5 mt -58.39 -41.12 84.16 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.575 1.15 . . . . 0.0 113.692 174.065 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -46.87 88.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -58.85 -44.51 91.03 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 124.675 1.235 . . . . 0.0 108.462 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -46.73 86.55 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.493 1.517 . . . . 0.0 113.131 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -62.1 -42.44 99.22 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.702 1.601 . . . . 0.0 110.204 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -72.43 -24.17 61.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 117.276 -1.345 . . . . 0.0 112.065 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.21 -37.07 61.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.711 1.205 . . . . 0.0 108.874 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 N--CA 1.477 0.881 0 O-C-N 120.186 -1.571 . . . . 0.0 113.093 176.715 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.0 mtt . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -128.74 -42.08 1.45 Allowed 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 126.988 2.115 . . . . 0.0 108.765 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.4 mm -56.85 -52.41 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.278 0 CA-C-N 119.607 1.094 . . . . 0.0 109.039 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 34.8 mt -53.6 -33.12 53.82 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 82.0 mt -79.43 -54.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 C-N-CA 124.069 0.948 . . . . 0.0 110.208 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.17 -36.97 93.19 Favored Glycine 0 CA--C 1.523 0.546 0 CA-C-N 119.635 1.107 . . . . 0.0 111.692 -174.806 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -48.42 71.7 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.661 174.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.48 -31.25 69.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.459 1.103 . . . . 0.0 111.451 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.3 t -64.78 -57.78 9.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.314 1.046 . . . . 0.0 108.852 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.35 -32.4 73.99 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.226 -178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -131.48 87.4 46.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 126.069 1.747 . . . . 0.0 109.652 -174.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.33 -17.99 39.24 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.504 1.469 . . . . 0.0 113.23 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -61.28 -22.51 64.92 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.064 1.302 . . . . 0.0 110.731 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.509 HD22 ' CD2' ' A' ' 535' ' ' PHE . 76.9 mt -57.05 -19.14 17.31 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.106 0.962 . . . . 0.0 112.205 174.137 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.1 -26.04 68.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.737 0.699 . . . . 0.0 112.462 174.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 85.6 m -83.9 -19.85 34.04 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.816 0.847 . . . . 0.0 111.069 174.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 9.6 mt -87.45 -14.75 39.62 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.452 0.701 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -82.68 140.93 44.25 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.795 1.179 . . . . 0.0 109.749 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.81 164.91 17.45 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.421 2.747 . . . . 0.0 110.817 173.636 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -65.93 8.95 0.24 Allowed 'Trans proline' 0 CA--C 1.549 1.265 0 C-N-CA 124.871 3.714 . . . . 0.0 115.866 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.42 HD13 HD12 ' A' ' 474' ' ' LEU . 1.0 OUTLIER 90.49 -0.13 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 132.256 4.222 . . . . 0.0 113.535 175.118 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -34.52 -58.23 0.49 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.611 2.364 . . . . 0.0 115.724 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -98.07 2.76 49.07 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.42 HD12 HD13 ' A' ' 471' ' ' LEU . 80.8 mt -85.11 -65.66 0.98 Allowed 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.943 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 24.5 t0 57.88 118.8 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.446 1.898 . . . . 0.0 111.172 -173.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.92 -27.33 65.16 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.296 -1.502 . . . . 0.0 111.285 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -68.93 -23.58 64.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 117.548 -1.215 . . . . 0.0 112.206 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -84.93 -20.02 31.3 Favored 'General case' 0 C--N 1.348 0.529 0 CA-C-N 121.337 1.88 . . . . 0.0 111.393 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 546' ' ' LEU . 1.2 mt -128.98 91.85 41.46 Favored Pre-proline 0 C--O 1.235 0.318 0 CA-C-N 119.364 0.984 . . . . 0.0 111.309 -173.235 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.16 85.23 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 124.114 3.209 . . . . 0.0 111.618 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.03 -22.33 2.45 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 125.505 1.526 . . . . 0.0 112.066 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.74 -32.09 68.91 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.963 1.382 . . . . 0.0 110.524 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -53.05 -32.55 42.7 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.301 0.955 . . . . 0.0 113.836 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.25 -44.35 95.42 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 119.584 1.692 . . . . 0.0 110.763 173.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -66.02 -39.6 90.36 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.671 0.789 . . . . 0.0 110.333 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.48 76.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 118.499 0.59 . . . . 0.0 110.255 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.94 -56.56 18.26 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.821 1.648 . . . . 0.0 108.186 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.57 -52.85 53.07 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.212 1.405 . . . . 0.0 111.964 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 468' ' ' VAL . 43.8 t -58.41 -42.49 84.29 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 CA-C-N 119.684 1.129 . . . . 0.0 109.931 178.442 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.58 -47.95 80.72 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.989 0.813 . . . . 0.0 109.818 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 94.2 m -63.0 -40.45 97.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.732 2.013 . . . . 0.0 110.51 176.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.5 m -64.64 -39.64 94.05 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 120.927 -1.108 . . . . 0.0 110.448 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.76 -16.86 64.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.966 0.906 . . . . 0.0 112.19 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.6 -41.16 12.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.739 1.615 . . . . 0.0 112.194 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -79.33 109.62 12.1 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 120.145 1.339 . . . . 0.0 110.1 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.75 108.96 2.68 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 121.217 1.278 . . . . 0.0 109.661 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.85 54.97 5.57 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.09 0.853 . . . . 0.0 111.705 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.1 165.76 8.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.411 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.93 168.31 20.06 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 176.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.4 m -49.24 -51.68 31.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.242 1.417 . . . . 0.0 110.152 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -79.37 -37.12 25.08 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -174.615 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.47 -31.43 72.58 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.253 0.621 . . . . 0.0 109.995 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 62.6 tp -60.48 -51.97 67.2 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 124.096 0.958 . . . . 0.0 110.349 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.44 -36.08 75.25 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 118.965 -0.54 . . . . 0.0 109.841 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.13 -38.95 75.69 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.318 0.508 . . . . 0.0 110.653 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -69.8 -21.22 63.42 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.663 0.665 . . . . 0.0 112.121 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -105.89 8.65 32.72 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.169 -1.582 . . . . 0.0 109.015 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -54.45 120.66 6.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 119.542 -1.974 . . . . 0.0 111.409 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 88.89 10.2 67.08 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.207 -0.774 . . . . 0.0 113.376 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.82 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.0 m -92.26 152.49 19.79 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.941 1.371 . . . . 0.0 108.028 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.17 -16.25 42.57 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 121.259 -0.901 . . . . 0.0 112.448 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.82 ' H ' HG22 ' A' ' 510' ' ' THR . 7.9 t-20 -93.93 -15.12 25.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.133 0.973 . . . . 0.0 111.103 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -53.75 -49.31 68.45 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.079 0.854 . . . . 0.0 110.461 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.89 58.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.739 0.699 . . . . 0.0 112.581 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 90.7 m -66.29 -44.79 82.51 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.894 -0.504 . . . . 0.0 110.285 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.22 -37.59 88.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.425 0.69 . . . . 0.0 111.011 178.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -62.08 -49.34 76.34 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.695 1.998 . . . . 0.0 108.531 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -55.06 -42.04 72.22 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.57 0.748 . . . . 0.0 110.952 174.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 87.7 mt -79.24 -13.56 59.6 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.476 0.71 . . . . 0.0 112.332 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 5.5 t -75.5 -51.64 12.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.19 0.996 . . . . 0.0 108.814 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 1.3 ptm -87.45 33.26 0.69 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 127.14 2.176 . . . . 0.0 111.135 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -88.02 94.92 9.94 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.394 1.092 . . . . 0.0 113.269 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -62.71 -7.8 5.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 128.175 2.59 . . . . 0.0 113.364 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.08 -13.96 62.15 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.564 1.945 . . . . 0.0 112.153 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 2.5 pt -137.87 -60.36 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.234 1.814 . . . . 0.0 110.304 -176.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 53.85 0.86 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.92 3.288 . . . . 0.0 117.822 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 527' ' ' ASP . . . . . 0.535 ' CG ' ' H ' ' A' ' 528' ' ' LYS . 28.6 t70 -108.47 -173.84 2.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.759 1.163 . . . . 0.0 112.795 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.535 ' H ' ' CG ' ' A' ' 527' ' ' ASP . 0.0 OUTLIER -142.98 -25.84 0.6 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.284 2.634 . . . . 0.0 111.153 -174.017 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -82.67 -58.69 2.79 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 173.963 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 56.7 mt -55.87 -33.25 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.553 1.141 . . . . 0.0 108.463 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.99 -50.01 67.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.547 1.139 . . . . 0.0 112.531 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.56 -39.29 94.01 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.717 0.77 . . . . 0.0 110.17 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -68.59 -47.1 67.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.701 -0.624 . . . . 0.0 110.245 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 77.5 m -67.24 -27.27 67.08 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 112.154 175.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.509 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.6 t80 -65.03 -53.38 46.82 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 26.0 m -55.8 -44.54 77.9 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 124.44 1.096 . . . . 0.0 109.995 177.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.25 -45.88 82.78 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.9 t -64.89 -44.6 89.11 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.579 -0.7 . . . . 0.0 109.666 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 5.6 tt -56.51 -51.32 68.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.593 1.157 . . . . 0.0 109.776 174.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -61.6 -44.99 95.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.841 -178.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.43 -29.71 70.75 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.482 1.913 . . . . 0.0 109.872 175.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.01 -59.91 3.63 Favored 'General case' 0 C--N 1.342 0.243 0 O-C-N 120.735 -1.228 . . . . 0.0 107.787 173.199 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -59.35 -47.94 83.51 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 124.596 1.159 . . . . 0.0 110.527 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -50.16 -53.95 24.2 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 128.39 2.676 . . . . 0.0 109.479 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 16.7 t -67.3 -36.48 81.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.931 0.332 . . . . 0.0 111.588 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 479' ' ' LEU . 18.7 mt -65.93 -35.92 81.93 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 119.961 -1.712 . . . . 0.0 110.022 177.081 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 32.0 mt -71.65 -38.36 70.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.188 1.395 . . . . 0.0 110.003 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.57 -53.98 51.83 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 108.492 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 65.7 mt -56.73 -46.76 81.14 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.837 1.255 . . . . 0.0 110.223 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -63.72 -36.89 85.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 118.398 -0.81 . . . . 0.0 111.032 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.22 -52.88 63.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.03 -39.06 91.01 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.706 0.685 . . . . 0.0 109.998 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.04 -45.87 91.68 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.5 1.12 . . . . 0.0 111.014 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.321 0.4 OUTLIER -76.24 -34.25 59.2 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.222 -0.924 . . . . 0.0 110.648 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.5 mm -66.52 -34.53 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 119.612 1.096 . . . . 0.0 109.241 173.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.33 82.83 Favored 'General case' 0 CA--C 1.522 -0.102 0 O-C-N 120.424 -1.423 . . . . 0.0 109.892 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -68.64 -5.53 20.69 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.12 176.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 -50.51 11.13 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 121.206 1.821 . . . . 0.0 109.69 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -77.25 14.68 0.87 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.915 1.286 . . . . 0.0 113.916 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.521 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -143.28 -81.78 0.19 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.454 -0.779 . . . . 0.0 109.04 176.095 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.521 ' H ' HG23 ' A' ' 560' ' ' THR . 2.3 m170 -61.53 -40.88 96.26 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.079 1.351 . . . . 0.0 112.615 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 95.96 126.64 5.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.979 1.276 . . . . 0.0 111.735 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -73.64 166.01 24.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 173.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 16.3 m -103.53 166.53 10.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.61 -36.24 69.2 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.495 -173.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -76.46 -53.3 8.31 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.32 1.013 . . . . 0.0 109.348 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.43 -26.91 68.95 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.361 0.982 . . . . 0.0 113.199 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.465 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -72.85 -26.33 61.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.384 -1.447 . . . . 0.0 110.274 175.107 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.2 -27.16 28.21 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.721 1.608 . . . . 0.0 110.373 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -52.05 -41.58 62.42 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 173.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.465 HD12 ' HA ' ' A' ' 568' ' ' ARG . 4.2 mt -61.04 -37.53 82.93 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.028 -1.463 . . . . 0.0 113.806 177.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -49.68 76.89 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 121.014 1.734 . . . . 0.0 107.916 174.388 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.4 m -65.24 -44.99 86.42 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.615 0.572 . . . . 0.0 110.25 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -43.87 80.3 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.459 1.104 . . . . 0.0 110.65 175.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.91 -34.24 77.01 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 121.523 -0.736 . . . . 0.0 110.893 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.38 -37.87 77.76 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.986 0.812 . . . . 0.0 110.392 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -68.3 -32.03 71.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.263 0.483 . . . . 0.0 110.118 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 N--CA 1.466 0.352 0 O-C-N 121.121 -0.987 . . . . 0.0 110.205 176.821 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 4.5 tmm? . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 123.386 1.565 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -127.9 -48.55 1.36 Allowed 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 116.928 -1.511 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.565 HD12 ' CG2' ' A' ' 534' ' ' THR . 6.6 mm -61.15 -40.35 85.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.791 174.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.8 mt -62.31 -52.99 61.47 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 120.294 1.406 . . . . 0.0 109.907 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.593 HG23 HD13 ' A' ' 488' ' ' LEU . 73.5 mt -70.33 -55.33 14.91 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 117.787 -1.102 . . . . 0.0 110.86 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -49.22 -55.71 11.93 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.573 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -50.97 -46.68 61.34 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 117.175 -1.393 . . . . 0.0 113.412 174.846 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.3 tm? -61.95 -29.97 70.6 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 124.306 1.004 . . . . 0.0 111.345 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 22.2 t -67.81 -54.77 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 124.446 1.099 . . . . 0.0 109.126 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -74.6 -11.47 60.21 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.778 -0.576 . . . . 0.0 112.068 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.737 ' HB3' HD12 ' A' ' 464' ' ' LEU . 5.3 t-20 -142.33 78.05 17.04 Favored Pre-proline 0 N--CA 1.445 -0.71 0 CA-C-N 118.513 0.597 . . . . 0.0 110.297 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -65.57 -20.15 60.27 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 121.518 1.479 . . . . 0.0 111.206 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.55 -25.54 64.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.973 1.309 . . . . 0.0 111.509 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.737 HD12 ' HB3' ' A' ' 461' ' ' ASN . 25.9 mt -61.81 -15.09 38.9 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-N 119.285 0.948 . . . . 0.0 110.155 173.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 458' ' ' LEU . . . -61.65 -40.44 94.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.219 -0.925 . . . . 0.0 110.039 173.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 83.4 m -72.88 -17.93 61.47 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.882 -1.136 . . . . 0.0 111.348 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 3.5 mt -84.99 -27.68 26.29 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.267 1.027 . . . . 0.0 109.665 175.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -60.8 144.98 89.19 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.635 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.595 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.5 Cg_endo -69.86 168.55 21.37 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.165 1.91 . . . . 0.0 111.012 175.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -71.17 1.12 5.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.878 3.052 . . . . 0.0 114.004 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 474' ' ' LEU . 3.2 mp 72.95 58.76 0.11 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 129.396 3.079 . . . . 0.0 109.338 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.02 -37.08 29.74 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.322 -0.861 . . . . 0.0 110.938 -173.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.1 17.42 21.66 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 125.295 1.438 . . . . 0.0 112.291 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 471' ' ' LEU . 15.2 mt -106.41 -94.9 0.36 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.232 -1.366 . . . . 0.0 109.004 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 46.6 t0 78.92 142.99 0.08 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.376 2.271 . . . . 0.0 109.83 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.93 -19.37 62.59 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.135 -0.978 . . . . 0.0 109.805 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -59.92 -43.17 95.08 Favored 'General case' 0 C--N 1.341 0.212 0 O-C-N 121.078 -1.013 . . . . 0.0 110.07 174.325 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -32.58 43.97 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 118.878 -0.582 . . . . 0.0 110.42 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 482' ' ' LEU . 60.4 mt -131.9 96.2 20.85 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 125.839 1.655 . . . . 0.0 108.821 -174.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.28 1.95 3.68 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 123.428 2.752 . . . . 0.0 113.165 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -109.36 -13.53 16.95 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 120.99 -1.069 . . . . 0.0 111.838 174.044 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.656 HD23 ' O ' ' A' ' 482' ' ' LEU . 5.6 tt -61.06 -35.43 76.92 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 116.687 -1.625 . . . . 0.0 108.816 174.11 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -41.95 -46.56 5.09 Favored Glycine 0 N--CA 1.479 1.536 0 CA-C-N 119.746 1.157 . . . . 0.0 111.553 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 488' ' ' LEU . 0.2 OUTLIER -60.66 -49.12 78.8 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.581 0.752 . . . . 0.0 110.709 177.756 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -59.8 -46.11 90.24 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.243 1.017 . . . . 0.0 111.274 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -49.69 76.05 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 117.611 -1.185 . . . . 0.0 107.994 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.64 -39.65 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.996 0.918 . . . . 0.0 110.601 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.755 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.13 -54.1 50.8 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.833 1.253 . . . . 0.0 111.329 174.461 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 468' ' ' VAL . 88.8 t -60.04 -46.1 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 116.773 -1.584 . . . . 0.0 108.288 175.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -54.9 -50.06 69.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.377 1.871 . . . . 0.0 109.028 -175.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.6 m -58.0 -50.65 72.68 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.74 173.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.1 m -61.2 -36.86 81.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.685 1.584 . . . . 0.0 112.75 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -21.41 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 128.562 2.745 . . . . 0.0 110.974 173.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.32 -58.79 1.98 Allowed 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 117.658 -1.163 . . . . 0.0 108.669 173.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.596 ' HB3' HD13 ' A' ' 498' ' ' LEU . 97.2 mm-40 -46.24 93.06 0.05 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 128.345 2.658 . . . . 0.0 112.148 -173.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -73.16 119.84 6.25 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.653 2.235 . . . . 0.0 110.643 -173.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 66.32 36.99 92.44 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 495' ' ' GLN . 14.3 tp -61.7 160.94 10.76 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-O 121.216 0.531 . . . . 0.0 110.139 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.97 165.83 24.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 90.3 m -53.68 -41.64 67.1 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.381 1.473 . . . . 0.0 109.825 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.06 -40.81 11.01 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -62.74 -29.43 70.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.052 0.541 . . . . 0.0 111.552 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.09 -53.73 53.39 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.86 -37.3 71.11 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.38 0.536 . . . . 0.0 111.578 176.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.04 -40.53 87.18 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.163 -0.336 . . . . 0.0 111.085 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -66.72 -15.71 63.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.777 1.231 . . . . 0.0 111.917 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -116.87 16.23 15.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.906 1.682 . . . . 0.0 109.158 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -56.98 131.8 50.9 Favored 'General case' 0 C--N 1.34 0.172 0 O-C-N 120.465 -1.397 . . . . 0.0 108.936 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.62 74.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-O 119.683 -0.51 . . . . 0.0 112.456 173.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.805 HG22 ' H ' ' A' ' 512' ' ' ASN . 32.2 m -110.41 147.68 33.52 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.602 1.161 . . . . 0.0 108.485 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -61.09 -22.1 64.3 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 111.424 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.805 ' H ' HG22 ' A' ' 510' ' ' THR . 5.2 m-20 -92.26 -16.95 25.46 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 124.884 1.274 . . . . 0.0 109.775 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.55 68.03 Favored 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.58 -45.83 63.26 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.899 0.88 . . . . 0.0 112.589 178.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 52.9 m -66.27 -43.99 84.87 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.866 -0.521 . . . . 0.0 109.843 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.755 HD21 HD11 ' A' ' 488' ' ' LEU . 50.3 mt -61.73 -38.39 87.77 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.818 1.247 . . . . 0.0 111.808 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -71.07 -41.02 71.25 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 127.314 2.246 . . . . 0.0 109.399 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -61.38 -38.44 87.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 86.7 mt -78.55 -11.53 59.97 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.694 -0.669 . . . . 0.0 112.634 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 22.7 t -79.75 -55.69 4.82 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 119.186 0.903 . . . . 0.0 108.769 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -74.01 5.99 3.79 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.279 1.431 . . . . 0.0 113.256 176.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -61.56 126.35 27.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.628 -0.67 . . . . 0.0 110.362 -173.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -110.82 6.22 21.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.908 2.083 . . . . 0.0 109.823 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.59 -30.57 70.88 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.558 -1.339 . . . . 0.0 109.958 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.1 pt -113.31 -77.91 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 129.148 2.979 . . . . 0.0 110.824 -174.569 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.7 57.75 5.65 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.286 1.434 . . . . 0.0 111.295 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -145.84 179.47 7.43 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.519 -0.738 . . . . 0.0 110.183 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -128.48 -37.88 1.78 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.444 2.297 . . . . 0.0 110.545 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -79.32 -59.74 2.64 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.096 1.758 . . . . 0.0 108.962 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 32.1 mt -60.23 -24.77 31.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-O 117.852 -1.071 . . . . 0.0 108.253 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.6 -66.75 0.34 Allowed 'General case' 0 C--N 1.347 0.473 0 C-N-CA 125.012 1.325 . . . . 0.0 110.199 176.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -45.83 63.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.184 0.594 . . . . 0.0 110.274 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -62.65 -50.88 69.47 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.573 -176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' THR . . . . . 0.565 ' CG2' HD12 ' A' ' 453' ' ' ILE . 9.7 m -61.01 -34.43 74.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 126.331 1.852 . . . . 0.0 110.867 176.566 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.452 ' CD1' HD13 ' A' ' 464' ' ' LEU . 78.9 t80 -63.1 -57.23 11.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.204 0.911 . . . . 0.0 109.593 178.049 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 43.8 m -60.0 -42.2 93.75 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.982 -1.009 . . . . 0.0 109.4 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -54.85 -47.11 74.58 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.483 1.513 . . . . 0.0 110.354 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.3 t -62.67 -56.19 19.98 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.851 1.66 . . . . 0.0 109.901 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.518 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -48.63 -57.26 6.5 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.805 177.353 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -54.76 -44.24 73.45 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 126.826 2.05 . . . . 0.0 109.801 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -60.75 -44.04 97.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.473 1.109 . . . . 0.0 111.621 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -56.97 11.65 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.453 ' CD1' HD21 ' A' ' 474' ' ' LEU . 27.1 m-85 -56.64 -48.51 77.37 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.417 0.448 . . . . 0.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -51.28 -53.98 30.45 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.328 1.851 . . . . 0.0 110.734 175.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 43.8 t -53.92 -44.42 70.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.95 -43.36 83.35 Favored 'General case' 0 C--O 1.225 -0.215 0 O-C-N 120.72 -1.238 . . . . 0.0 109.275 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.09 -48.52 78.4 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.405 1.482 . . . . 0.0 109.572 174.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.04 -54.4 42.0 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.425 1.09 . . . . 0.0 110.214 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 20.2 mt -54.7 -38.33 66.91 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 123.63 0.772 . . . . 0.0 109.558 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -65.37 -52.94 50.24 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -53.8 -51.05 64.73 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.517 1.127 . . . . 0.0 108.054 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.87 -41.1 99.26 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.027 -176.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -52.81 62.55 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 127.141 2.177 . . . . 0.0 109.863 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -58.15 -51.3 70.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.852 1.261 . . . . 0.0 108.835 -179.134 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.88 -37.31 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.729 -1.232 . . . . 0.0 110.217 175.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.25 -10.13 56.35 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 126.268 1.827 . . . . 0.0 111.057 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -96.75 9.45 41.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 116.704 -1.617 . . . . 0.0 109.642 173.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -100.57 -46.67 5.12 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.53 1.968 . . . . 0.0 111.198 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.13 -16.28 63.94 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.883 -1.136 . . . . 0.0 112.595 179.094 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.616 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.5 t -113.38 -105.33 0.39 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.616 ' H ' HG23 ' A' ' 560' ' ' THR . 1.2 m170 -44.15 -56.03 4.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 128.234 2.614 . . . . 0.0 113.159 -173.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 116.98 133.05 4.98 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 128.318 2.866 . . . . 0.0 108.303 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.2 mt -78.41 -171.27 2.36 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.9 m -137.19 171.83 13.9 Favored 'General case' 0 CA--C 1.498 -1.022 0 O-C-N 119.458 -2.026 . . . . 0.0 110.324 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.24 -48.18 74.31 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 113.248 -1.796 . . . . 0.0 109.05 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -72.91 -48.89 33.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.371 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -56.16 -43.34 78.26 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.147 0.579 . . . . 0.0 110.293 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -60.76 -37.57 82.3 Favored 'General case' 0 C--N 1.346 0.425 0 O-C-N 121.14 -0.975 . . . . 0.0 111.251 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.443 HD13 ' HD1' ' A' ' 572' ' ' TRP . 3.3 mm? -74.99 -33.46 61.84 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 122.836 0.455 . . . . 0.0 109.916 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -60.91 -40.71 94.2 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 120.443 -1.41 . . . . 0.0 107.586 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.7 mt -59.84 -41.98 92.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 116.654 -1.641 . . . . 0.0 110.475 173.273 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.444 ' CE3' ' HG2' ' A' ' 576' ' ' GLN . 0.0 OUTLIER -55.97 -51.41 67.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.261 1.846 . . . . 0.0 106.974 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -59.55 -38.17 80.36 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 125.554 1.784 . . . . 0.0 109.123 -173.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.18 -52.69 57.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.396 1.478 . . . . 0.0 111.46 176.074 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -61.03 -45.75 93.51 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.54 1.936 . . . . 0.0 110.804 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' GLN . . . . . 0.444 ' HG2' ' CE3' ' A' ' 572' ' ' TRP . 2.1 mp0 -67.43 -26.37 66.38 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 118.143 -0.932 . . . . 0.0 110.365 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -32.38 73.84 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.569 1.148 . . . . 0.0 110.559 173.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 179.252 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.6 ptt? . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -61.29 -31.95 71.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.39 -2.243 . . . . 0.0 111.662 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 13.1 mm -63.23 -52.41 58.99 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 121.124 1.783 . . . . 0.0 108.791 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 10.7 mt -53.13 -50.38 64.62 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.522 1.055 . . . . 0.0 110.432 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.623 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 mt -59.0 -59.71 3.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.329 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.82 99.45 Favored Glycine 0 C--O 1.223 -0.535 0 CA-C-N 119.939 1.245 . . . . 0.0 112.54 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 525' ' ' ILE . 1.0 OUTLIER -61.48 -43.51 98.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.565 -0.962 . . . . 0.0 108.619 177.095 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.511 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.1 tm? -65.79 -35.75 81.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.947 1.299 . . . . 0.0 111.373 175.1 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 455' ' ' ILE . 75.2 t -59.9 -56.3 18.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 O-C-N 120.994 -1.066 . . . . 0.0 108.3 174.137 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 460' ' ' GLN . . . . . 0.518 ' OE1' HG12 ' A' ' 459' ' ' VAL . 2.2 mp0 -75.39 -9.92 58.99 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.981 -0.45 . . . . 0.0 111.944 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -147.14 73.25 12.08 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 125.125 1.37 . . . . 0.0 109.894 -177.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.74 -19.99 59.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.782 2.321 . . . . 0.0 112.668 -174.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.29 -21.82 64.29 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.978 1.711 . . . . 0.0 110.153 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.425 HD13 ' CD1' ' A' ' 535' ' ' PHE . 76.5 mt -63.82 -13.51 45.1 Favored 'General case' 0 C--N 1.351 0.644 0 O-C-N 120.441 -1.412 . . . . 0.0 110.513 173.253 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.38 -32.64 74.37 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.122 0.874 . . . . 0.0 110.243 173.787 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.1 m -77.75 -17.35 57.64 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.783 -1.198 . . . . 0.0 110.943 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.79 -11.92 38.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 117.605 -1.188 . . . . 0.0 112.244 174.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 469' ' ' PRO . 2.4 p -94.5 151.28 39.18 Favored Pre-proline 0 CA--C 1.542 0.671 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.549 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.7 Cg_endo -72.77 177.72 7.26 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.42 2.747 . . . . 0.0 112.519 175.574 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.9 5.22 3.58 Favored 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.421 2.747 . . . . 0.0 114.643 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 474' ' ' LEU 0.254 1.8 mm? 71.18 47.81 0.39 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 129.342 3.057 . . . . 0.0 114.291 179.525 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -87.95 -20.09 26.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -173.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -106.05 -3.08 22.0 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.448 -1.407 . . . . 0.0 111.895 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.654 HD21 ' CE1' ' A' ' 543' ' ' PHE . 3.5 mp -109.1 -78.53 0.59 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 125.511 1.525 . . . . 0.0 108.508 -173.612 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 11.0 t70 62.61 162.73 0.09 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.121 1.768 . . . . 0.0 110.987 -173.274 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.8 -21.79 60.93 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.429 -1.419 . . . . 0.0 108.755 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -51.74 -43.29 62.84 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.159 2.584 . . . . 0.0 110.032 173.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -84.09 -49.7 8.65 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.477 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 13.0 mt -114.28 102.22 54.67 Favored Pre-proline 0 N--CA 1.47 0.556 0 C-N-CA 123.588 0.755 . . . . 0.0 112.034 -173.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.21 -26.03 15.18 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.56 2.174 . . . . 0.0 111.422 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -85.91 -15.98 64.19 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.646 -1.086 . . . . 0.0 112.656 174.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -25.55 65.22 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 119.021 1.41 . . . . 0.0 108.806 173.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.66 -48.35 7.38 Favored Glycine 0 C--O 1.218 -0.895 0 CA-C-N 119.85 1.205 . . . . 0.0 111.146 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -46.81 87.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.154 0.977 . . . . 0.0 110.677 176.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -59.74 -49.37 78.01 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.596 -0.69 . . . . 0.0 110.846 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -64.66 -44.85 89.1 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 124.881 1.272 . . . . 0.0 110.028 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.37 -49.45 76.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.753 1.221 . . . . 0.0 108.131 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.15 -51.33 70.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.342 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.49 HG11 ' CG1' ' A' ' 468' ' ' VAL . 38.6 t -56.69 -46.79 83.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 124.656 1.182 . . . . 0.0 109.935 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -58.32 -46.76 85.57 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.019 1.327 . . . . 0.0 108.587 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' THR . . . . . 0.409 HG21 ' HE1' ' A' ' 507' ' ' TYR . 18.1 m -64.53 -39.68 94.21 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 124.188 0.995 . . . . 0.0 110.364 173.388 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.511 ' SG ' HD11 ' A' ' 458' ' ' LEU . 81.1 m -62.99 -41.96 99.71 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 120.777 1.626 . . . . 0.0 110.775 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.57 -22.84 67.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.667 1.587 . . . . 0.0 111.355 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.1 t -85.25 -50.44 7.36 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.752 0.821 . . . . 0.0 110.206 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -67.6 104.44 0.66 Allowed Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.3 1.84 . . . . 0.0 110.424 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -68.09 122.55 9.64 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.097 1.865 . . . . 0.0 110.018 -174.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.12 40.4 99.14 Favored Glycine 0 C--N 1.34 0.764 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 503' ' ' LEU . 34.8 tp -57.35 155.64 8.82 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.255 1.026 . . . . 0.0 110.662 175.552 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 2.4 p -143.0 163.36 32.99 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 37.4 m -50.41 -48.58 56.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.653 1.981 . . . . 0.0 110.431 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.6 17.36 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -59.89 -24.41 64.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.757 1.223 . . . . 0.0 111.569 176.322 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 498' ' ' LEU . 9.7 tp -61.66 -49.45 76.47 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 119.666 1.121 . . . . 0.0 110.097 175.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 517' ' ' GLU . 3.1 mp -64.25 -33.58 76.13 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.883 -0.579 . . . . 0.0 111.818 176.31 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -68.87 -45.78 70.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.734 0.814 . . . . 0.0 108.836 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -63.59 -17.17 62.58 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.952 -1.093 . . . . 0.0 113.04 174.815 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.5 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 20.5 m-85 -110.81 13.6 22.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.315 1.446 . . . . 0.0 109.1 177.362 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -56.19 129.45 40.22 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 119.576 -1.952 . . . . 0.0 109.133 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 78.64 8.2 87.79 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 118.979 -0.901 . . . . 0.0 113.967 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.787 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -92.5 146.85 23.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.058 1.429 . . . . 0.0 108.412 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -19.64 54.76 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 121.174 -0.954 . . . . 0.0 111.043 176.207 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.787 ' H ' HG22 ' A' ' 510' ' ' THR . 1.6 m-20 -94.22 -18.68 21.45 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.492 1.917 . . . . 0.0 111.508 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -49.96 -40.75 44.81 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.538 1.135 . . . . 0.0 110.608 176.134 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.61 66.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.461 2.304 . . . . 0.0 110.081 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' THR . . . . . 0.545 HG22 HD11 ' A' ' 519' ' ' LEU . 6.8 m -58.51 -54.16 50.21 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 117.061 -1.447 . . . . 0.0 107.285 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 516' ' ' LEU . 2.6 mm? -53.95 -42.49 68.93 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.76 1.164 . . . . 0.0 110.878 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.605 ' HA ' HD21 ' A' ' 504' ' ' LEU . 6.3 tt0 -62.58 -46.71 87.1 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.304 1.842 . . . . 0.0 111.405 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -32.51 72.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.471 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.545 HD11 HG22 ' A' ' 515' ' ' THR . 31.4 mt -76.44 -22.74 54.24 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.169 174.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.1 t -65.17 -58.8 5.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 121.334 1.879 . . . . 0.0 111.824 -178.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.99 1.38 5.73 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.479 1.511 . . . . 0.0 113.517 175.065 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.53 ' CE3' HD11 ' A' ' 525' ' ' ILE . 2.7 t90 -71.46 86.15 0.85 Allowed 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.428 1.091 . . . . 0.0 109.591 -173.8 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.19 -12.7 19.36 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.719 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.63 -13.65 0.7 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 128.028 2.531 . . . . 0.0 114.159 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.702 HD13 ' CD2' ' A' ' 457' ' ' LEU . 4.3 mt -57.61 -78.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 C-N-CA 128.406 2.682 . . . . 0.0 111.685 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -171.28 -86.7 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 124.166 1.936 . . . . 0.0 114.165 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -157.84 158.15 34.61 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 127.048 2.139 . . . . 0.0 111.649 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -27.54 69.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 119.175 0.898 . . . . 0.0 112.746 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -71.36 -50.97 26.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.077 1.308 . . . . 0.0 109.416 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 10.5 mt -74.46 -4.17 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.584 1.554 . . . . 0.0 109.857 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.03 -63.35 1.33 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.553 1.07 . . . . 0.0 108.715 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -51.62 -43.75 62.68 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 122.7 0.4 . . . . 0.0 110.215 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -54.06 51.26 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.568 0.747 . . . . 0.0 111.399 175.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 57.8 m -57.23 -35.74 70.05 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.512 1.125 . . . . 0.0 110.641 176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.425 ' CD1' HD13 ' A' ' 464' ' ' LEU . 87.5 t80 -67.12 -57.9 5.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.095 0.862 . . . . 0.0 111.077 177.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.8 m -54.69 -45.03 73.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.069 -0.967 . . . . 0.0 109.183 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -62.0 -38.85 90.18 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.315 0.961 . . . . 0.0 110.575 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.6 t -62.98 -56.98 12.36 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.081 1.352 . . . . 0.0 110.672 174.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -49.09 -48.22 44.49 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.678 1.191 . . . . 0.0 108.19 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -57.9 -49.62 76.11 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -61.57 -35.27 77.32 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.777 1.231 . . . . 0.0 113.033 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.23 28.65 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 173.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.654 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.9 m-85 -59.89 -43.14 94.95 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.285 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.4 -51.64 66.17 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 110.206 174.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 14.8 t -52.08 -49.31 63.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.295 1.038 . . . . 0.0 110.194 173.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 474' ' ' LEU . 33.0 mt -67.13 -39.67 86.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.652 -174.273 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.63 -43.67 88.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 126.307 1.843 . . . . 0.0 109.696 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.06 -51.47 69.05 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 126.245 1.818 . . . . 0.0 109.298 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 4.5 mt -55.26 -51.6 66.11 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.74 1.216 . . . . 0.0 108.994 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.9 ttm-85 -58.82 -53.39 58.95 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.709 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -48.85 -51.81 27.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.827 1.251 . . . . 0.0 109.403 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.04 -38.53 82.63 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.467 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -50.83 70.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.106 1.762 . . . . 0.0 108.939 176.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.634 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.5 mt -57.9 -53.31 59.65 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.973 1.709 . . . . 0.0 108.96 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.5 -35.44 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 121.134 1.788 . . . . 0.0 109.985 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.17 -24.78 67.8 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.658 -1.276 . . . . 0.0 110.754 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -96.5 -1.54 47.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 116.179 -1.867 . . . . 0.0 109.773 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -43.11 14.2 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 122.974 2.625 . . . . 0.0 111.119 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -72.05 -3.76 24.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.601 2.36 . . . . 0.0 115.034 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.531 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -138.63 -89.31 0.22 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -176.911 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.531 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -48.49 -41.46 29.94 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.21 1.804 . . . . 0.0 112.054 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 72.36 80.04 0.42 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 109.08 -1.608 . . . . 0.0 109.08 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.45 158.27 0.29 Allowed 'General case' 0 C--O 1.238 0.487 0 O-C-N 124.937 1.022 . . . . 0.0 109.823 172.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.84 160.87 25.11 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.036 0.922 . . . . 0.0 110.489 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -37.84 74.22 Favored 'General case' 0 N--CA 1.458 -0.035 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.792 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.87 -53.34 57.08 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 125.717 1.607 . . . . 0.0 110.189 175.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -40.92 73.15 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.293 1.406 . . . . 0.0 112.457 174.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.46 ' HA ' HD12 ' A' ' 571' ' ' LEU . 20.3 ttm180 -63.1 -37.36 86.9 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.381 -1.45 . . . . 0.0 110.158 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.415 HD23 ' HD1' ' A' ' 572' ' ' TRP . 4.8 mt -71.13 -38.84 72.28 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.042 -1.456 . . . . 0.0 108.958 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -50.91 -44.12 59.96 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.424 1.011 . . . . 0.0 109.361 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.634 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.4 mt -56.58 -41.34 76.78 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 117.053 -1.451 . . . . 0.0 114.331 173.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.415 ' HD1' HD23 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -62.94 -45.66 91.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 121.982 2.174 . . . . 0.0 107.085 179.482 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -54.11 49.88 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -41.77 66.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.038 1.735 . . . . 0.0 111.825 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.22 -39.7 89.78 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.55 -1.344 . . . . 0.0 109.885 -177.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -74.7 -21.42 59.4 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.152 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -81.15 -34.63 32.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.485 1.514 . . . . 0.0 111.359 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.681 0 C-N-CA 124.959 1.304 . . . . 0.0 111.464 174.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -42.53 78.27 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 116.1 -1.905 . . . . 0.0 109.246 173.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.6 mm -58.24 -52.88 53.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.2 mt -50.88 -47.67 60.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 120.2 1.363 . . . . 0.0 110.264 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.571 HG23 HD13 ' A' ' 488' ' ' LEU . 56.5 mt -62.35 -58.07 9.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 124.969 1.307 . . . . 0.0 110.765 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -58.81 -37.52 90.51 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.885 2.183 . . . . 0.0 112.022 -177.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 81.1 mt -65.89 -41.95 90.9 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 117.523 -1.227 . . . . 0.0 108.838 173.587 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -30.3 68.19 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 120.202 1.365 . . . . 0.0 111.375 175.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.582 ' HA ' HD22 ' A' ' 503' ' ' LEU . 17.4 t -64.11 -54.8 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 124.582 1.153 . . . . 0.0 109.239 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -80.16 -10.12 59.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.916 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.61 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.5 t-20 -138.17 74.11 43.17 Favored Pre-proline 0 N--CA 1.448 -0.528 0 C-N-CA 123.371 0.668 . . . . 0.0 110.783 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.8 Cg_endo -65.55 -18.45 59.36 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.881 1.721 . . . . 0.0 112.066 -177.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.23 -20.68 61.51 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 123.839 0.856 . . . . 0.0 110.329 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.61 HD12 ' HB3' ' A' ' 461' ' ' ASN . 27.3 mt -62.68 -12.81 25.87 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.926 1.694 . . . . 0.0 110.029 176.593 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.87 74.54 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.015 0.926 . . . . 0.0 111.13 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 51.6 m -78.59 -17.04 56.69 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.685 1.13 . . . . 0.0 111.262 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.52 -23.37 22.06 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.753 1.221 . . . . 0.0 110.821 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.781 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -78.54 150.78 76.79 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 118.54 0.609 . . . . 0.0 109.464 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.781 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.6 Cg_endo -75.56 168.31 24.7 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.435 2.09 . . . . 0.0 112.124 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.49 3.87 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.703 3.602 . . . . 0.0 113.647 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 486' ' ' ARG . 3.2 mp 68.54 63.47 0.34 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.604 1.962 . . . . 0.0 110.739 176.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -89.74 -38.98 13.45 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.779 0.8 . . . . 0.0 111.138 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -108.39 0.56 21.19 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.452 2.701 . . . . 0.0 110.808 -176.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.58 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.7 mm? -84.16 -91.15 0.09 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.247 -2.872 . . . . 0.0 103.247 -177.199 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 41.6 t0 65.02 150.36 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.764 1.626 . . . . 0.0 110.72 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' GLU . . . . . 0.419 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 12.2 mt-10 -78.63 -17.97 55.21 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 120.147 -1.596 . . . . 0.0 109.072 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.33 -31.47 70.32 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.195 1.398 . . . . 0.0 111.216 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -94.93 -27.43 15.68 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.748 175.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 546' ' ' LEU . 3.0 mm? -125.06 89.01 53.34 Favored Pre-proline 0 C--O 1.237 0.433 0 CA-C-N 119.321 0.964 . . . . 0.0 110.801 -176.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.96 76.51 0.83 Allowed 'Trans proline' 0 CA--C 1.541 0.865 1 C-N-CA 125.962 4.442 . . . . 0.0 110.378 -175.175 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 144.7 -19.09 2.01 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.884 1.707 . . . . 0.0 113.905 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.94 -25.12 66.57 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 116.973 -1.489 . . . . 0.0 109.543 173.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 483' ' ' GLY . . . . . 0.419 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -44.22 -42.32 6.82 Favored Glycine 0 C--O 1.217 -0.928 0 CA-C-N 120.449 1.477 . . . . 0.0 110.763 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.519 HD23 HD13 ' A' ' 455' ' ' ILE . 33.1 tp -58.17 -51.09 71.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.554 1.177 . . . . 0.0 112.643 176.263 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.416 ' O ' HG23 ' A' ' 489' ' ' VAL . 80.0 t80 -58.2 -52.46 65.49 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 126.303 1.841 . . . . 0.0 110.79 173.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.571 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.1 OUTLIER -53.35 -51.58 62.01 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.671 1.588 . . . . 0.0 108.58 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.39 -42.42 83.37 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.23 1.412 . . . . 0.0 109.974 -176.705 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.571 HD13 HG23 ' A' ' 455' ' ' ILE . 0.2 OUTLIER -57.78 -48.69 78.95 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 124.481 1.112 . . . . 0.0 110.615 177.131 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 468' ' ' VAL . 84.5 t -63.62 -48.12 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 117.756 -1.116 . . . . 0.0 108.356 175.837 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -52.34 -41.65 63.21 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.117 1.326 . . . . 0.0 109.77 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.9 m -72.01 -42.16 66.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 126.513 1.925 . . . . 0.0 112.019 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.7 m -62.56 -39.77 94.73 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.199 1.363 . . . . 0.0 110.549 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -24.26 67.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.914 1.686 . . . . 0.0 111.975 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.58 -56.71 4.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.518 1.527 . . . . 0.0 107.997 174.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.9 100.0 0.23 Allowed Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 124.353 1.061 . . . . 0.0 111.267 -173.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.28 138.25 75.92 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 N-CA-C 107.274 -1.856 . . . . 0.0 107.274 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 55.93 36.61 67.36 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 124.528 1.061 . . . . 0.0 112.833 173.692 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 462' ' ' PRO . 7.2 tp -64.28 151.62 43.25 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.78 163.81 19.51 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.309 2.243 . . . . 0.0 107.665 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 91.6 m -58.57 -44.03 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.208 1.003 . . . . 0.0 111.18 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.46 -34.04 60.73 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -67.38 -29.0 68.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.616 1.208 . . . . 0.0 111.531 -177.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.582 HD22 ' HA ' ' A' ' 459' ' ' VAL . 13.8 tp -58.87 -51.96 67.78 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.121 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.65 -30.22 67.15 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.454 0.702 . . . . 0.0 111.569 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -71.86 -43.73 64.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.11 0.868 . . . . 0.0 112.468 176.094 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -63.86 -18.28 64.0 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.078 1.751 . . . . 0.0 111.859 173.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.521 ' CD2' HD13 ' A' ' 516' ' ' LEU . 69.1 m-85 -117.58 17.71 14.39 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.697 1.999 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -62.03 -19.22 62.65 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 121.357 1.89 . . . . 0.0 114.158 -176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -136.06 42.26 1.34 Allowed Glycine 0 C--O 1.227 -0.311 0 C-N-CA 124.996 1.284 . . . . 0.0 110.852 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.707 HG22 ' H ' ' A' ' 512' ' ' ASN . 48.7 m -108.09 145.99 33.26 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -21.35 65.39 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 121.217 -0.927 . . . . 0.0 112.011 174.524 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.707 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m-20 -88.95 -26.28 21.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 130.817 3.647 . . . . 0.0 109.675 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -40.49 -43.89 1.93 Allowed 'General case' 0 C--O 1.206 -1.203 0 C-N-CA 124.24 1.016 . . . . 0.0 110.426 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.77 -52.63 47.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.876 1.67 . . . . 0.0 113.217 176.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 89.7 m -63.73 -45.21 90.91 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 124.842 1.257 . . . . 0.0 109.693 174.893 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.521 HD13 ' CD2' ' A' ' 507' ' ' TYR . 42.9 mt -60.52 -34.52 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.292 1.037 . . . . 0.0 111.21 177.516 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -40.77 64.46 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 127.04 2.136 . . . . 0.0 109.412 -178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -64.55 -37.94 89.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.497 HD22 ' CE3' ' A' ' 522' ' ' TRP . 88.0 mt -77.32 -10.9 59.72 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 118.395 -0.812 . . . . 0.0 112.515 173.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 9.4 t -69.92 -66.04 0.64 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.192 1.397 . . . . 0.0 108.388 177.786 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.38 14.36 2.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.459 1.904 . . . . 0.0 111.742 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.678 ' CE3' HD11 ' A' ' 525' ' ' ILE . 4.4 t90 -53.69 123.97 13.8 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -28.62 15.55 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.281 -173.583 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -49.75 -30.26 9.12 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 125.502 1.521 . . . . 0.0 111.031 -177.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.678 HD11 ' CE3' ' A' ' 522' ' ' TRP . 1.6 pt -110.27 -70.84 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 130.834 3.654 . . . . 0.0 112.457 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.38 52.09 3.67 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 126.877 2.071 . . . . 0.0 112.311 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 527' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 531' ' ' ALA . 3.3 t70 -151.11 150.21 30.41 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.61 -174.138 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -106.88 -27.71 10.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.364 1.066 . . . . 0.0 111.983 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -87.66 -60.75 1.89 Allowed 'General case' 0 CA--C 1.51 -0.584 0 C-N-CA 124.567 1.147 . . . . 0.0 108.936 -177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 45.0 mt -55.55 -28.12 22.35 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 527' ' ' ASP . . . -50.69 -60.32 3.16 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.814 1.246 . . . . 0.0 111.206 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -52.74 -42.97 65.41 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 119.058 0.844 . . . . 0.0 110.602 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -49.48 69.64 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.31 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 61.2 m -58.94 -31.37 68.63 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.156 1.782 . . . . 0.0 107.75 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.524 ' CD1' HD13 ' A' ' 464' ' ' LEU . 39.4 t80 -66.55 -58.05 6.0 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 109.551 178.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 80.6 m -63.23 -39.6 95.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.706 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -60.02 -45.18 93.62 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.467 1.107 . . . . 0.0 108.361 175.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.7 t -70.4 -51.77 27.23 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.479 -1.388 . . . . 0.0 112.002 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.3 tt -46.8 -49.94 19.13 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 126.708 2.003 . . . . 0.0 111.083 170.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.267 0.9 OUTLIER -65.68 -33.56 76.18 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-O 116.04 -1.933 . . . . 0.0 110.342 179.071 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -72.04 -35.45 69.35 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.049 1.295 . . . . 0.0 110.36 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -57.72 9.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.58 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.5 m-85 -58.76 -42.38 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 126.487 1.915 . . . . 0.0 111.343 -177.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.68 -49.14 78.66 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 127.551 2.341 . . . . 0.0 109.096 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.6 t -56.59 -35.62 68.44 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.626 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 479' ' ' LEU . 16.2 mt -74.0 -40.82 62.67 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.712 1.205 . . . . 0.0 111.087 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 30.8 mt -61.7 -44.86 96.13 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 117.517 -1.23 . . . . 0.0 109.0 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.046 0.938 . . . . 0.0 111.476 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 549' ' ' LEU . . . . . 0.564 HD23 ' N ' ' A' ' 550' ' ' ARG . 0.2 OUTLIER -54.33 -45.55 72.69 Favored 'General case' 0 CA--C 1.451 -2.85 0 C-N-CA 124.493 1.117 . . . . 0.0 111.346 173.704 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 550' ' ' ARG . . . . . 0.564 ' N ' HD23 ' A' ' 549' ' ' LEU . 1.3 ttm-85 -63.98 -51.07 66.01 Favored 'General case' 0 C--N 1.272 -2.777 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.69 -51.95 52.04 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.654 1.182 . . . . 0.0 109.149 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.89 -43.24 99.26 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.063 -176.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -40.21 95.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.196 1.798 . . . . 0.0 110.373 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 571' ' ' LEU . 4.2 mt -60.72 -55.13 36.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.697 1.199 . . . . 0.0 107.835 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.9 mm -61.57 -39.54 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 120.255 1.389 . . . . 0.0 111.763 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -60.25 -18.29 47.87 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.503 1.521 . . . . 0.0 109.542 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.18 18.49 12.19 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 120.577 1.535 . . . . 0.0 111.39 173.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.85 -63.83 1.4 Allowed 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 121.164 1.802 . . . . 0.0 109.523 177.321 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -8.8 53.51 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.181 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.05 -43.01 3.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.358 1.435 . . . . 0.0 109.886 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -115.06 -74.18 0.62 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.495 1.518 . . . . 0.0 109.09 -173.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 148.62 109.18 0.52 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -79.78 132.74 36.22 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.3 t -66.57 165.32 14.86 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.88 -39.9 86.87 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.759 . . . . 0.0 110.624 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.73 -51.56 26.56 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 123.995 0.918 . . . . 0.0 109.343 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -59.0 -30.4 67.96 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 123.793 1.759 . . . . 0.0 111.526 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.97 -38.37 72.78 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 118.785 -2.447 . . . . 0.0 106.147 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 18.4 mt -67.76 -32.9 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.487 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.5 -43.55 62.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.131 1.332 . . . . 0.0 108.912 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.0 OUTLIER -61.78 -39.84 93.1 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 117.423 -1.275 . . . . 0.0 112.803 177.205 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -50.48 72.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.166 1.803 . . . . 0.0 108.172 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -35.91 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 124.146 0.904 . . . . 0.0 109.404 -175.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -52.61 37.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.789 1.636 . . . . 0.0 110.95 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -57.4 -46.22 83.7 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.464 1.906 . . . . 0.0 111.468 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.8 -24.72 65.33 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 111.66 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.21 -33.89 43.36 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 119.257 0.935 . . . . 0.0 109.346 173.757 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.875 0 C-N-CA 128.024 2.53 . . . . 0.0 109.869 -176.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 46.5 ttm . . . . . 0 N--CA 1.463 0.215 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -56.02 -19.23 11.85 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.26 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.4 mm -51.99 -52.14 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 125.167 1.387 . . . . 0.0 109.409 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.54 -42.71 67.76 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.494 0.588 . . . . 0.0 111.517 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.527 HG23 HD22 ' A' ' 488' ' ' LEU . 43.8 mt -69.39 -53.08 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.227 0.611 . . . . 0.0 109.553 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -64.18 -43.43 97.12 Favored Glycine 0 C--N 1.336 0.534 0 CA-C-N 118.749 0.704 . . . . 0.0 112.679 -173.898 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.22 -41.68 96.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.154 177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.411 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.4 tm? -64.77 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.83 0.741 . . . . 0.0 110.68 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.63 -50.96 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 121.599 -0.688 . . . . 0.0 109.541 173.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -72.59 -28.63 62.91 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.293 -174.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -133.55 84.47 45.61 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 126.895 2.078 . . . . 0.0 111.643 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -65.36 -21.48 61.03 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 121.945 1.763 . . . . 0.0 113.3 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.64 -17.02 62.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.069 0.849 . . . . 0.0 111.278 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.41 -15.58 58.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.207 -0.933 . . . . 0.0 110.673 173.77 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.77 -25.47 67.27 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 119.452 1.024 . . . . 0.0 111.047 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 7.9 m -83.41 -12.82 56.01 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.066 0.946 . . . . 0.0 110.789 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 20.8 mt -103.17 -7.55 21.15 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 112.478 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -92.32 137.89 24.5 Favored Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 119.995 1.27 . . . . 0.0 109.692 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.05 164.72 24.0 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.17 2.58 . . . . 0.0 110.355 173.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.72 16.57 0.27 Allowed 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 123.474 2.783 . . . . 0.0 115.515 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.543 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.5 mm? 69.38 16.4 8.3 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 128.367 2.667 . . . . 0.0 113.249 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -57.79 -20.26 34.11 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.129 2.572 . . . . 0.0 115.396 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.3 10.08 19.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.34 1.456 . . . . 0.0 111.826 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.1 mp -124.13 -58.21 1.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.047 0.939 . . . . 0.0 111.731 -173.463 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 25.8 t0 64.59 157.25 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.533 1.533 . . . . 0.0 108.866 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -75.27 -21.96 58.14 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 119.711 -1.868 . . . . 0.0 107.576 173.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -61.8 -49.21 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.291 2.237 . . . . 0.0 113.202 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 48.0 mmtt -77.21 -20.31 55.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.715 -0.659 . . . . 0.0 112.497 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -120.78 88.29 43.69 Favored Pre-proline 0 N--CA 1.453 -0.282 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.53 87.95 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.99 2.46 . . . . 0.0 111.307 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.46 -19.02 2.82 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.276 1.893 . . . . 0.0 112.589 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 8.7 tt -62.77 -25.1 68.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.822 1.311 . . . . 0.0 111.499 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.66 -40.06 17.12 Favored Glycine 0 CA--C 1.527 0.822 0 CA-C-N 118.607 0.64 . . . . 0.0 112.054 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.89 -40.91 97.62 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.735 1.267 . . . . 0.0 112.696 174.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -61.86 -42.59 99.23 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.716 -1.24 . . . . 0.0 109.074 174.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -61.91 -47.56 84.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.294 1.038 . . . . 0.0 110.76 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.23 -56.44 14.67 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 127.238 2.215 . . . . 0.0 109.473 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 455' ' ' ILE . 2.8 mp -56.25 -59.68 4.59 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.586 1.155 . . . . 0.0 109.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 468' ' ' VAL . 72.6 t -54.68 -42.86 63.38 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.164 0 C-N-CA 123.361 0.664 . . . . 0.0 109.628 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -59.64 -44.8 93.36 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 119.131 0.878 . . . . 0.0 110.798 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.5 m -63.76 -41.61 97.96 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 123.503 0.721 . . . . 0.0 109.898 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 458' ' ' LEU . 88.5 m -62.97 -44.49 95.91 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 119.002 0.819 . . . . 0.0 110.074 -177.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -18.46 47.05 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.748 1.219 . . . . 0.0 112.817 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.8 t -99.46 -11.84 20.73 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.901 1.68 . . . . 0.0 113.023 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -106.29 90.69 4.95 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 125.234 1.414 . . . . 0.0 109.791 -176.644 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.23 122.7 10.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.845 1.697 . . . . 0.0 110.082 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 75.41 30.45 58.48 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 119.481 -0.622 . . . . 0.0 112.406 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 37.9 tp -56.07 153.3 9.18 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.81 0.805 . . . . 0.0 110.065 174.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -136.29 166.61 23.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.4 m -47.02 -49.99 20.15 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.098 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.32 -33.46 19.98 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -64.63 -27.19 68.77 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.373 0.669 . . . . 0.0 110.356 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.5 -48.65 74.38 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.358 0.663 . . . . 0.0 109.999 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.7 mp -62.67 -31.11 71.94 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.969 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -68.62 -48.84 63.07 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.693 0.679 . . . . 0.0 109.711 173.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -65.83 -20.66 66.32 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.688 -0.632 . . . . 0.0 112.349 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -107.11 8.81 30.39 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.977 0.911 . . . . 0.0 110.773 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.24 -14.88 12.43 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -173.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -118.54 12.29 12.27 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.722 1.153 . . . . 0.0 113.67 174.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.795 HG22 ' H ' ' A' ' 512' ' ' ASN . 90.8 m -94.06 146.97 23.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 119.849 1.825 . . . . 0.0 110.652 -174.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -9.87 9.8 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.396 1.078 . . . . 0.0 112.7 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.795 ' H ' HG22 ' A' ' 510' ' ' THR . 0.1 OUTLIER -94.82 -16.51 22.89 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.962 2.105 . . . . 0.0 112.201 177.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.45 -48.06 7.15 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.626 1.17 . . . . 0.0 113.232 -175.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.08 -43.92 87.29 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.311 0.505 . . . . 0.0 111.876 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.3 m -66.87 -37.91 85.32 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.722 -0.611 . . . . 0.0 110.726 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.37 -45.33 73.09 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.29 1.036 . . . . 0.0 110.965 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.24 -44.76 95.82 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -60.98 -35.39 76.68 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.857 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 39.8 mt -74.94 -27.14 60.07 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.412 1.46 . . . . 0.0 112.832 175.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 1.2 t -62.64 -47.23 84.63 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.86 12.99 11.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.635 1.574 . . . . 0.0 114.188 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -65.91 125.45 25.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.851 0.834 . . . . 0.0 111.732 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -81.44 -25.17 36.35 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 130.979 3.712 . . . . 0.0 114.308 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.64 -20.15 65.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.544 0.737 . . . . 0.0 112.331 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 4.9 pt -125.76 -64.62 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.268 1.027 . . . . 0.0 110.692 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 50.38 3.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 129.823 3.249 . . . . 0.0 118.179 174.459 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -114.92 164.84 13.57 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.724 1.147 . . . . 0.0 110.798 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.2 pttt -118.3 -13.43 9.84 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.942 1.697 . . . . 0.0 113.097 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.67 -53.56 4.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 120.44 1.473 . . . . 0.0 108.394 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.11 -24.39 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.149 1.779 . . . . 0.0 109.213 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.54 -45.34 66.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.455 1.102 . . . . 0.0 112.316 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -63.06 -51.6 66.03 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.364 0.984 . . . . 0.0 109.155 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -55.19 -44.76 75.59 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.378 0.671 . . . . 0.0 110.469 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.6 m -71.58 -29.69 65.0 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.652 0.781 . . . . 0.0 111.423 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -69.04 -51.42 39.21 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.69 1.132 . . . . 0.0 108.09 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 82.6 m -54.17 -45.45 72.09 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.305 1.042 . . . . 0.0 109.39 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -62.79 -47.72 82.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.043 0.838 . . . . 0.0 110.813 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -43.73 79.82 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.94 -52.52 62.71 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.991 0.917 . . . . 0.0 108.574 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -58.55 -45.11 89.63 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.963 0.905 . . . . 0.0 110.681 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -69.42 -35.04 75.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 119.414 1.006 . . . . 0.0 110.688 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -56.05 24.71 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 173.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 10.7 m-85 -61.97 -48.34 80.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.931 0.893 . . . . 0.0 110.474 -176.14 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -55.67 -42.13 74.68 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.035 2.134 . . . . 0.0 111.787 176.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.8 t -67.08 -39.49 86.83 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.49 0.716 . . . . 0.0 111.764 174.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 41.8 mt -68.23 -38.37 81.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.434 -0.791 . . . . 0.0 109.908 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -46.35 88.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 109.001 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -64.2 -43.25 95.61 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.405 0.682 . . . . 0.0 111.131 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.84 -49.22 77.14 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.948 -1.095 . . . . 0.0 111.203 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 38.4 ttt-85 -57.8 -40.41 79.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 124.456 1.102 . . . . 0.0 109.668 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -56.09 -49.21 74.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.248 174.01 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -66.88 -36.98 83.55 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.048 1.295 . . . . 0.0 111.41 -175.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -55.19 -52.36 63.58 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.209 1.404 . . . . 0.0 109.766 174.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.474 ' HB3' HD11 ' A' ' 571' ' ' LEU . 13.8 mt -60.86 -55.42 33.22 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.11 0.964 . . . . 0.0 110.332 177.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.443 ' CD1' HD13 ' A' ' 571' ' ' LEU . 26.5 mm -63.61 -31.81 54.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 O-C-N 121.726 -0.609 . . . . 0.0 109.972 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.36 97.5 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.306 0.957 . . . . 0.0 109.927 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -69.06 -23.83 64.09 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 116.368 -1.777 . . . . 0.0 110.968 173.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.08 -41.0 74.67 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.795 2.543 . . . . 0.0 109.863 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -75.91 5.1 6.94 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -174.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.18 -79.98 0.14 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 119.176 0.898 . . . . 0.0 109.633 175.093 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.48 ' H ' HG23 ' A' ' 560' ' ' THR . 5.8 t-80 -47.39 -48.12 26.17 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 127.666 2.386 . . . . 0.0 113.662 -173.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 84.99 87.53 0.91 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 -173.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.3 172.52 11.03 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.78 158.7 24.18 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.268 0.627 . . . . 0.0 110.001 -175.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.46 -41.14 89.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.317 0.58 . . . . 0.0 109.44 174.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 566' ' ' GLU . . . . . 0.495 ' CD ' ' H ' ' A' ' 566' ' ' GLU . 23.5 mp0 -57.08 -52.9 63.44 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 129.068 2.947 . . . . 0.0 107.784 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -62.61 -39.94 95.38 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.554 1.542 . . . . 0.0 111.394 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -69.73 -23.75 63.44 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.177 -1.577 . . . . 0.0 110.271 177.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 57.0 mt -84.52 -38.99 19.37 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.145 1.378 . . . . 0.0 110.26 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -50.95 -44.49 60.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.844 1.202 . . . . 0.0 108.619 174.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 568' ' ' ARG . 17.5 mt -53.55 -40.95 65.96 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.999 0.92 . . . . 0.0 112.874 174.227 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 121.102 1.774 . . . . 0.0 109.21 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.2 m -56.69 -52.96 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.476 1.11 . . . . 0.0 108.776 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.9 tp -52.81 -47.95 67.26 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.561 1.545 . . . . 0.0 111.042 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -60.23 -37.82 81.52 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.711 0.804 . . . . 0.0 112.31 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -80.03 -35.74 36.8 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.426 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.76 -31.89 72.1 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.566 0.746 . . . . 0.0 109.9 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--N 1.33 -0.256 0 C-N-CA 124.071 0.948 . . . . 0.0 110.638 178.255 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptm . . . . . 0 N--CA 1.453 -0.281 0 CA-C-O 120.482 0.182 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 23.5 mtt85 -74.9 -21.99 58.89 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.535 1.147 . . . . 0.0 110.34 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.504 HD13 ' HA ' ' A' ' 453' ' ' ILE . 1.8 mm -75.14 -45.43 41.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.506 1.129 . . . . 0.0 109.346 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.536 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 4.1 mm? -59.14 -47.23 86.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.578 1.174 . . . . 0.0 109.298 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.578 HG22 HD13 ' A' ' 519' ' ' LEU . 24.3 mt -72.79 -54.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.134 . . . . 0.0 109.265 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -45.46 -49.27 11.36 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.552 1.157 . . . . 0.0 111.005 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.726 HD11 HG22 ' A' ' 534' ' ' THR . 38.3 mt -66.1 -42.7 88.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.452 0.737 . . . . 0.0 109.33 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 465' ' ' ALA . 1.9 tm? -64.81 -26.91 68.55 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.517 1.136 . . . . 0.0 109.372 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.494 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 3.6 t -69.56 -52.56 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.446 1.091 . . . . 0.0 109.342 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 460' ' ' GLN . . . . . 0.407 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 4.4 mt-30 -75.49 -27.45 58.81 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.477 1.11 . . . . 0.0 110.23 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.739 ' HB3' HD12 ' A' ' 464' ' ' LEU . 3.1 t-20 -129.6 90.04 45.01 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.513 1.133 . . . . 0.0 109.269 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 -13.81 21.2 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.451 1.764 . . . . 0.0 111.028 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -77.11 -9.41 58.72 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.497 1.123 . . . . 0.0 110.311 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.766 HD22 ' CD2' ' A' ' 535' ' ' PHE . 18.7 mt -75.7 -15.16 60.33 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.443 1.089 . . . . 0.0 109.269 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.645 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -62.01 -31.53 71.92 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.517 1.136 . . . . 0.0 109.342 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 2.6 m -76.72 -13.22 60.06 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.53 1.144 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.689 HD12 HD23 ' A' ' 464' ' ' LEU . 19.5 mt -97.07 -9.12 28.69 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.53 1.144 . . . . 0.0 109.232 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.852 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.5 OUTLIER -97.62 146.43 31.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.483 1.114 . . . . 0.0 109.322 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.3 Cg_endo -75.01 175.29 11.44 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 124.457 1.767 . . . . 0.0 111.034 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 471' ' ' LEU . 18.5 Cg_endo -74.96 5.29 4.05 Favored 'Trans proline' 0 C--N 1.358 1.075 0 O-C-N 124.488 1.783 . . . . 0.0 111.018 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 1.021 ' CD1' HD12 ' A' ' 474' ' ' LEU . 3.4 mm? 68.63 70.49 0.29 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.484 1.115 . . . . 0.0 109.301 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.68 -62.51 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 0.0 110.296 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.88 -1.39 34.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.125 . . . . 0.0 109.319 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 1.021 HD12 ' CD1' ' A' ' 471' ' ' LEU . 7.6 mt -90.88 -61.97 1.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 1.191 . . . . 0.0 109.261 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 15.8 t0 60.77 152.81 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.498 1.124 . . . . 0.0 109.215 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -90.42 15.84 9.92 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.468 1.105 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -111.65 -34.04 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.49 1.119 . . . . 0.0 109.328 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -81.05 -21.17 40.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 0.0 109.317 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.458 ' CB ' ' HB2' ' A' ' 482' ' ' LEU . 46.4 mt -126.03 106.03 25.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.547 1.154 . . . . 0.0 109.313 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 73.98 4.17 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.502 1.79 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 152.18 -21.38 0.86 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.895 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.85 ' O ' HD13 ' A' ' 482' ' ' LEU . 2.1 tm? -54.3 -35.82 63.03 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 0.78 . . . . 0.0 109.336 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.29 -50.97 9.52 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.508 1.13 . . . . 0.0 111.047 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.47 -46.49 73.37 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.447 0.734 . . . . 0.0 109.348 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.536 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 46.8 t80 -65.55 -40.35 92.75 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.448 ' HB2' ' CD1' ' A' ' 482' ' ' LEU . 2.8 ttt85 -66.52 -49.12 67.56 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.511 1.132 . . . . 0.0 110.333 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.6 -47.22 80.09 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.495 1.122 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 1.009 HD11 HD21 ' A' ' 516' ' ' LEU . 1.4 mt -63.42 -49.69 72.74 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.507 1.129 . . . . 0.0 109.279 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.78 HG11 HG11 ' A' ' 468' ' ' VAL . 17.5 t -58.66 -49.75 81.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.529 1.143 . . . . 0.0 109.338 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -53.96 -39.38 65.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.474 1.109 . . . . 0.0 109.338 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' THR . . . . . 0.477 HG23 HE22 ' A' ' 495' ' ' GLN . 1.1 m -73.71 -44.19 57.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.117 . . . . 0.0 110.384 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.419 ' HA ' HD22 ' A' ' 498' ' ' LEU . 66.5 m -56.1 -46.43 79.1 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.508 1.13 . . . . 0.0 108.227 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -22.19 43.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.508 1.13 . . . . 0.0 109.279 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.19 -53.25 5.91 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.572 1.17 . . . . 0.0 109.998 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 495' ' ' GLN . . . . . 0.573 ' OE1' ' CD2' ' A' ' 506' ' ' HIS . 2.1 mp0 -61.51 110.99 3.62 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.433 1.083 . . . . 0.0 110.285 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 126.25 9.83 Favored 'Trans proline' 0 C--N 1.36 1.135 0 O-C-N 124.47 1.774 . . . . 0.0 110.919 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.06 41.32 99.84 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 124.479 1.112 . . . . 0.0 110.969 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.894 HD21 HD13 ' A' ' 503' ' ' LEU . 43.2 tp -58.46 164.87 2.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.54 0.788 . . . . 0.0 109.387 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 499' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 503' ' ' LEU . 6.3 p -142.95 170.51 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.46 1.1 . . . . 0.0 110.403 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 460' ' ' GLN . 2.3 m -66.56 -35.05 79.27 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.44 1.087 . . . . 0.0 110.372 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -83.92 -55.06 2.88 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.479 1.112 . . . . 0.0 111.033 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -50.81 -29.65 12.2 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.459 0.741 . . . . 0.0 110.287 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.894 HD13 HD21 ' A' ' 498' ' ' LEU . 21.9 tp -56.05 -58.81 6.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 0.0 109.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -56.98 -34.57 68.23 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.409 1.068 . . . . 0.0 109.357 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -64.32 -34.52 78.34 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 506' ' ' HIS . . . . . 0.573 ' CD2' ' OE1' ' A' ' 495' ' ' GLN . 68.8 t60 -71.69 -13.55 61.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 0.0 109.538 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.762 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 37.6 m-85 -124.22 27.24 7.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 0.0 111.071 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.26 126.98 31.21 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.507 1.129 . . . . 0.0 110.352 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.12 29.11 57.27 Favored Glycine 0 CA--C 1.529 0.947 0 O-C-N 124.453 1.095 . . . . 0.0 111.002 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.852 HG22 ' H ' ' A' ' 512' ' ' ASN . 19.0 m -109.02 136.78 47.97 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 0.763 . . . . 0.0 110.373 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 57.4 m-20 -58.75 -15.7 13.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.0 109.288 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.852 ' H ' HG22 ' A' ' 510' ' ' THR . 0.6 OUTLIER -97.41 -22.42 16.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.483 1.115 . . . . 0.0 109.268 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 513' ' ' ALA . . . . . 0.762 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.54 -36.08 9.93 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 0.0 109.263 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.49 41.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.452 1.095 . . . . 0.0 109.291 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 68.6 m -58.32 -42.42 86.7 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.461 1.1 . . . . 0.0 110.361 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 1.009 HD21 HD11 ' A' ' 488' ' ' LEU . 13.6 mt -66.56 -33.64 76.13 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.408 1.067 . . . . 0.0 109.335 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -68.21 -47.72 67.12 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.477 1.111 . . . . 0.0 110.277 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -56.21 -38.64 71.29 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 1.146 . . . . 0.0 109.332 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 455' ' ' ILE . 94.5 mt -72.4 -21.73 61.23 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.478 1.111 . . . . 0.0 109.31 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.9 t -68.74 -59.33 3.18 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 0.0 110.071 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' MET . . . . . 0.403 ' O ' ' C ' ' A' ' 522' ' ' TRP . 0.3 OUTLIER -77.38 2.18 16.72 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.458 1.099 . . . . 0.0 111.009 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.654 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.9 t90 -42.07 137.67 1.8 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.146 . . . . 0.0 107.918 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.56 1.89 8.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -66.77 -24.3 66.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.488 1.117 . . . . 0.0 109.402 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.654 HD11 ' CE3' ' A' ' 522' ' ' TRP . 0.7 OUTLIER -113.46 -59.81 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.484 1.115 . . . . 0.0 109.239 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.36 61.76 2.09 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.448 1.092 . . . . 0.0 109.31 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 527' ' ' ASP . . . . . 0.556 ' OD2' HD12 ' A' ' 530' ' ' ILE . 3.7 t70 -161.94 153.21 18.25 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.559 1.162 . . . . 0.0 109.325 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.414 ' O ' ' HB3' ' A' ' 531' ' ' ALA . 8.1 pttt -115.93 -36.98 3.98 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.609 1.193 . . . . 0.0 109.29 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.53 -43.68 38.24 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.426 1.079 . . . . 0.0 109.291 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' ILE . . . . . 0.556 HD12 ' OD2' ' A' ' 527' ' ' ASP . 55.0 mt -70.91 -12.39 16.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.461 1.101 . . . . 0.0 109.345 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 457' ' ' LEU . . . -61.36 -58.19 9.24 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.44 1.088 . . . . 0.0 109.295 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -53.47 -48.07 69.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.411 1.069 . . . . 0.0 110.299 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -43.63 93.85 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.459 1.1 . . . . 0.0 110.304 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 534' ' ' THR . . . . . 0.726 HG22 HD11 ' A' ' 457' ' ' LEU . 3.7 m -66.47 -36.08 81.87 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.429 1.08 . . . . 0.0 110.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.766 ' CD2' HD22 ' A' ' 464' ' ' LEU . 18.9 t80 -61.51 -51.6 67.96 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.565 1.166 . . . . 0.0 111.033 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 53.8 m -64.61 -46.91 80.6 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.517 1.136 . . . . 0.0 110.345 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -58.37 -41.18 84.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.533 1.145 . . . . 0.0 109.286 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.7 t -69.8 -56.49 7.0 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.992 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.611 HD11 HG23 ' A' ' 468' ' ' VAL . 0.7 OUTLIER -48.36 -43.54 33.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.483 1.114 . . . . 0.0 109.268 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.14 -38.26 90.42 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.496 1.122 . . . . 0.0 109.321 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -62.71 -46.6 87.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.558 1.161 . . . . 0.0 109.601 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' MET . . . . . 0.412 ' O ' ' HG ' ' A' ' 546' ' ' LEU . 1.1 ttp -63.48 -44.9 93.08 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.478 1.111 . . . . 0.0 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.909 ' HA ' HD12 ' A' ' 546' ' ' LEU . 5.8 m-85 -68.84 -35.13 76.57 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.526 1.141 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.01 -44.85 83.56 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.52 1.138 . . . . 0.0 109.258 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.2 t -52.98 -37.65 61.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 0.0 109.994 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.909 HD12 ' HA ' ' A' ' 543' ' ' PHE . 1.2 mt -72.11 -50.58 26.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 0.0 109.234 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.409 HD22 HD11 ' A' ' 574' ' ' LEU . 79.1 mt -53.53 -36.15 61.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.542 1.151 . . . . 0.0 109.233 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -59.02 -55.33 36.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.8 -44.12 94.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.531 1.145 . . . . 0.0 109.304 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -48.85 62.59 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.527 1.142 . . . . 0.0 110.378 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 551' ' ' GLN . . . . . 0.543 ' HG3' HD23 ' A' ' 571' ' ' LEU . 27.1 tt0 -52.44 -45.7 66.11 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.528 1.142 . . . . 0.0 110.338 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.94 -47.76 79.2 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.548 1.155 . . . . 0.0 110.306 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -33.74 73.86 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.534 1.146 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.849 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.4 OUTLIER -69.87 -50.28 44.05 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 0.0 109.216 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 571' ' ' LEU . 28.0 mm -64.25 -30.6 50.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 124.523 1.139 . . . . 0.0 109.248 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' A' ' 560' ' ' THR . . . -57.14 -19.28 19.23 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.488 1.117 . . . . 0.0 109.346 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 557' ' ' ARG . . . . . 0.631 ' C ' HD23 ' A' ' 563' ' ' LEU . 7.8 mmt85 -104.44 3.43 32.17 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.546 1.154 . . . . 0.0 110.293 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 558' ' ' GLU . . . . . 0.587 ' HB2' HD21 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -104.86 -21.45 13.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.474 1.109 . . . . 0.0 110.298 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -108.83 7.62 26.26 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.609 1.193 . . . . 0.0 110.203 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 556' ' ' ALA . 16.9 p -114.01 -61.71 1.7 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.48 1.113 . . . . 0.0 110.362 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -118.93 -41.55 2.76 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.469 1.105 . . . . 0.0 109.567 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 562' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 558' ' ' GLU . . . 105.48 93.5 2.31 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.508 1.13 . . . . 0.0 111.028 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.631 HD23 ' C ' ' A' ' 557' ' ' ARG . 0.2 OUTLIER -55.83 -174.5 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 0.767 . . . . 0.0 109.265 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.37 145.85 55.64 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.061 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.754 ' O ' HD13 ' A' ' 569' ' ' LEU . 0.8 OUTLIER -52.94 -38.73 62.28 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.504 1.128 . . . . 0.0 109.265 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.51 -42.49 78.46 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.462 1.101 . . . . 0.0 110.312 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 567' ' ' GLU . . . . . 0.508 ' CB ' HD12 ' A' ' 563' ' ' LEU . 46.9 mm-40 -67.67 -41.16 84.15 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.557 1.161 . . . . 0.0 110.228 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.485 ' CG ' ' OE2' ' A' ' 558' ' ' GLU . 0.7 OUTLIER -60.56 -36.49 78.61 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.518 1.136 . . . . 0.0 110.217 -179.904 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 565' ' ' ASN . 7.6 mp -71.58 -37.62 70.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.493 1.12 . . . . 0.0 109.3 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -51.58 -37.65 50.76 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 110.367 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 555' ' ' ILE . 2.7 mt -60.21 -51.01 71.38 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.435 1.085 . . . . 0.0 109.29 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.603 ' CD2' ' N ' ' A' ' 573' ' ' THR . 0.0 OUTLIER -51.44 -57.55 8.68 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.503 1.127 . . . . 0.0 108.052 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.603 ' N ' ' CD2' ' A' ' 572' ' ' TRP . 1.4 m -55.12 -32.78 62.33 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.569 1.168 . . . . 0.0 110.421 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 574' ' ' LEU . . . . . 0.409 HD11 HD22 ' A' ' 547' ' ' LEU . 1.5 tp -70.95 -41.41 71.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.359 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -59.6 -33.52 71.58 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 0.0 109.235 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -22.5 65.76 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.0 110.334 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.27 -27.63 24.28 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.586 1.179 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--N 1.327 -0.408 0 O-C-N 124.488 1.118 . . . . 0.0 109.341 179.911 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.436 0 CA-C-O 121.441 0.639 . . . . 0.0 110.08 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.76 -46.28 0.87 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.024 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.492 HD12 HG23 ' A' ' 525' ' ' ILE . 18.7 mm -57.18 -52.4 56.86 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 124.305 1.042 . . . . 0.0 108.247 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.0 mt -51.74 -42.61 62.45 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-O 117.835 -1.079 . . . . 0.0 111.413 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.566 HD13 HD23 ' A' ' 484' ' ' LEU . 92.9 mt -65.43 -62.68 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 CA-C-N 119.614 1.097 . . . . 0.0 109.945 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -57.12 -40.59 91.76 Favored Glycine 0 C--N 1.337 0.587 0 CA-C-N 120.073 1.306 . . . . 0.0 113.58 -173.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.704 HD21 HG21 ' A' ' 525' ' ' ILE . 26.2 mt -67.42 -45.53 75.84 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -63.0 -33.83 76.25 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 119.153 0.888 . . . . 0.0 110.458 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.527 HG13 HD23 ' A' ' 503' ' ' LEU . 25.5 t -62.89 -51.52 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.489 -0.757 . . . . 0.0 109.394 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.41 -14.92 60.92 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.743 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -144.81 77.42 13.42 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 126.961 2.104 . . . . 0.0 109.165 -174.108 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.6 -13.75 35.54 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.256 1.971 . . . . 0.0 111.688 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.64 -23.07 63.43 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.701 1.601 . . . . 0.0 110.224 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 467' ' ' LEU . 56.1 mt -58.77 -18.13 29.2 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.79 1.177 . . . . 0.0 111.022 173.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 489' ' ' VAL . . . -63.3 -19.63 64.77 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.268 -0.895 . . . . 0.0 111.989 173.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 24.0 m -83.67 -18.71 37.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.879 0.872 . . . . 0.0 110.929 174.029 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 464' ' ' LEU . 81.9 mt -95.32 -19.15 20.2 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.673 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 489' ' ' VAL . 0.8 OUTLIER -72.01 150.27 92.53 Favored Pre-proline 0 CA--C 1.552 1.055 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 177.332 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.2 Cg_endo -74.69 172.92 15.28 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.958 3.106 . . . . 0.0 112.021 174.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.32 13.2 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 123.117 2.545 . . . . 0.0 114.339 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.642 HD13 HD12 ' A' ' 474' ' ' LEU . 2.6 mm? 61.79 60.59 1.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.262 2.225 . . . . 0.0 112.39 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.55 -68.88 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.353 1.061 . . . . 0.0 109.911 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -71.13 -0.55 9.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.642 HD12 HD13 ' A' ' 471' ' ' LEU . 17.7 mt -100.99 -81.72 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.23 1.012 . . . . 0.0 110.473 -175.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.1 t0 62.95 153.28 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.126 1.77 . . . . 0.0 112.37 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -75.49 -22.89 56.81 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.696 -1.253 . . . . 0.0 109.484 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -52.15 -46.57 65.48 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 125.483 1.513 . . . . 0.0 110.674 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -83.07 -29.9 28.43 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 47.0 mt -128.1 98.5 26.78 Favored Pre-proline 0 C--O 1.232 0.167 0 CA-C-N 119.698 1.136 . . . . 0.0 109.738 -173.674 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.46 -22.67 38.62 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.262 1.975 . . . . 0.0 112.328 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -89.62 -13.95 60.5 Favored Glycine 0 CA--C 1.525 0.716 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.291 174.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.74 -25.56 63.89 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.972 1.386 . . . . 0.0 110.233 175.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.67 -47.01 13.18 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.382 0.992 . . . . 0.0 111.944 173.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 0.566 HD23 HD13 ' A' ' 455' ' ' ILE . 39.8 tp -60.36 -49.56 77.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 117.734 0.767 . . . . 0.0 110.921 174.192 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -57.66 -51.28 70.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.567 1.076 . . . . 0.0 111.457 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -54.17 -52.77 60.11 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.044 0.937 . . . . 0.0 109.655 176.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -61.87 -43.75 98.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.755 0.707 . . . . 0.0 110.356 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.44 HD11 HD21 ' A' ' 516' ' ' LEU . 2.3 mp -54.99 -56.49 19.1 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.89 175.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 468' ' ' VAL . 75.6 t -57.25 -47.55 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.601 0.637 . . . . 0.0 109.78 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.09 -40.94 77.92 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.477 1.035 . . . . 0.0 109.856 -176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 13.2 m -69.27 -39.77 78.18 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.226 1.411 . . . . 0.0 111.204 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.561 ' HA ' HD22 ' A' ' 498' ' ' LEU . 99.5 m -62.17 -40.71 96.94 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.047 1.294 . . . . 0.0 110.472 176.051 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.03 -24.55 66.02 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 125.313 1.445 . . . . 0.0 111.113 175.74 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 7.1 t -79.8 -53.41 6.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.808 0.843 . . . . 0.0 110.599 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -68.9 104.64 0.77 Allowed Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 125.516 1.526 . . . . 0.0 110.018 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.23 125.68 12.17 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.261 1.974 . . . . 0.0 109.582 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 64.34 36.15 92.85 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.561 HD22 ' HA ' ' A' ' 492' ' ' CYS . 20.3 tp -57.1 156.21 7.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.653 0.739 . . . . 0.0 109.647 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 3.4 p -142.66 168.17 20.35 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.336 1.454 . . . . 0.0 108.193 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -52.3 -46.23 65.85 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.049 0.94 . . . . 0.0 110.738 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -76.69 -43.96 16.99 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -62.32 -27.82 69.31 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.4 1.08 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.527 HD23 HG13 ' A' ' 459' ' ' VAL . 61.4 tp -59.03 -57.0 15.04 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 124.192 0.997 . . . . 0.0 108.506 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.659 HD21 ' HA ' ' A' ' 517' ' ' GLU . 11.2 mp -62.44 -31.54 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.535 177.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -63.37 -44.69 94.07 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.35 0.977 . . . . 0.0 110.657 176.55 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -63.88 -15.13 58.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.53 1.132 . . . . 0.0 111.887 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -116.23 21.61 13.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.982 1.313 . . . . 0.0 110.129 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -57.26 123.0 13.82 Favored 'General case' 0 C--O 1.227 -0.111 0 O-C-N 120.153 -1.592 . . . . 0.0 110.6 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 72.83 31.71 62.0 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.5 -0.611 . . . . 0.0 113.592 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.839 HG22 ' H ' ' A' ' 512' ' ' ASN . 38.7 m -101.6 148.54 25.1 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.643 1.577 . . . . 0.0 110.073 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.24 -15.71 27.15 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.613 -0.679 . . . . 0.0 112.754 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.839 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 m-20 -101.83 -21.46 14.58 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -177.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -44.86 -48.19 11.11 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 119.959 1.254 . . . . 0.0 110.101 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.82 81.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.766 1.167 . . . . 0.0 111.972 -177.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 54.1 m -63.21 -53.06 59.04 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 174.794 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.44 HD21 HD11 ' A' ' 488' ' ' LEU . 54.2 mt -55.14 -39.71 69.76 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 124.525 1.13 . . . . 0.0 110.552 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.659 ' HA ' HD21 ' A' ' 504' ' ' LEU . 9.9 tt0 -68.87 -46.12 69.26 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 127.671 2.388 . . . . 0.0 110.234 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -56.8 -42.92 80.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.763 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.517 HD13 HG22 ' A' ' 455' ' ' ILE . 90.5 mt -78.4 -14.37 59.42 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.378 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.1 t -73.03 -28.48 62.37 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.41 1.084 . . . . 0.0 110.432 174.068 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -2.15 21.31 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.095 1.358 . . . . 0.0 112.61 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.563 ' CE3' HD11 ' A' ' 525' ' ' ILE . 24.3 t90 -70.96 83.55 0.67 Allowed 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.8 0.84 . . . . 0.0 109.621 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -1.39 58.01 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.311 2.245 . . . . 0.0 111.312 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.18 51.23 0.67 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.481 2.313 . . . . 0.0 109.878 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.704 HG21 HD21 ' A' ' 457' ' ' LEU . 55.0 mt -135.85 -71.37 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.408 2.283 . . . . 0.0 107.542 -173.752 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -170.67 -89.87 0.01 OUTLIER 'General case' 0 C--N 1.351 0.633 0 C-N-CA 125.968 1.707 . . . . 0.0 110.755 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -164.8 164.54 21.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.897 3.279 . . . . 0.0 107.717 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 10.6 ttmm -62.27 -26.88 68.64 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.306 1.442 . . . . 0.0 110.331 173.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -78.41 -60.57 2.32 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 119.774 1.17 . . . . 0.0 110.386 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.87 -20.9 20.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.528 1.131 . . . . 0.0 110.638 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.503 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -50.44 -43.16 54.94 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.233 174.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -58.34 -48.32 80.93 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.502 1.501 . . . . 0.0 110.098 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -47.16 77.79 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.183 -0.948 . . . . 0.0 110.671 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 87.4 m -63.94 -26.44 68.59 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.159 1.384 . . . . 0.0 111.717 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.486 ' CD1' HD13 ' A' ' 464' ' ' LEU . 88.9 t80 -72.21 -52.98 14.0 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 119.855 1.207 . . . . 0.0 108.68 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 23.1 m -61.86 -40.44 95.34 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 123.788 0.68 . . . . 0.0 110.285 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.02 -43.9 98.21 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.725 1.148 . . . . 0.0 110.847 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.0 t -64.6 -48.32 75.38 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 124.977 1.311 . . . . 0.0 111.895 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.19 -52.03 64.66 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-O 118.019 -0.991 . . . . 0.0 108.535 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -57.46 -41.02 79.76 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 123.933 0.893 . . . . 0.0 111.328 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -63.18 -38.99 93.33 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.144 0.429 . . . . 0.0 110.728 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.11 -51.28 59.42 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 121.595 -0.691 . . . . 0.0 109.704 176.422 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CE1' HD11 ' A' ' 474' ' ' LEU . 12.4 m-85 -57.77 -46.94 83.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.586 0.754 . . . . 0.0 110.745 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -54.99 -50.88 67.88 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.868 2.067 . . . . 0.0 110.025 173.917 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 12.3 t -53.66 -47.83 70.02 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 123.389 0.676 . . . . 0.0 109.878 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.444 ' CD1' HD23 ' A' ' 474' ' ' LEU . 60.7 mt -67.16 -42.34 84.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 119.292 0.951 . . . . 0.0 110.638 -175.455 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.49 -38.14 88.88 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.976 0.911 . . . . 0.0 110.158 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -52.22 37.65 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 126.03 1.732 . . . . 0.0 110.003 178.048 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 31.7 mt -52.49 -50.57 62.5 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 125.259 1.423 . . . . 0.0 107.932 173.848 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -40.21 94.66 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 120.691 -1.255 . . . . 0.0 111.449 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -60.01 -48.63 80.93 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.441 1.019 . . . . 0.0 108.329 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -42.08 95.44 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.331 -176.86 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -42.06 94.09 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.005 1.722 . . . . 0.0 110.282 -178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -73.03 -30.85 64.05 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.367 177.805 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.489 HD11 HD13 ' A' ' 571' ' ' LEU . 12.1 mm -76.18 -31.98 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 120.127 1.33 . . . . 0.0 110.341 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.89 -29.99 70.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.469 1.507 . . . . 0.0 108.094 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -90.58 15.37 11.01 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.328 1.451 . . . . 0.0 109.417 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -97.82 -50.58 4.38 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 122.186 2.267 . . . . 0.0 109.674 174.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -0.24 12.87 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.033 1.333 . . . . 0.0 113.537 -174.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.747 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.0 OUTLIER -131.89 -81.44 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 127.819 2.447 . . . . 0.0 108.984 179.385 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.747 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -56.12 -77.18 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.549 2.34 . . . . 0.0 106.605 -174.14 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 136.42 124.58 2.37 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.346 1.451 . . . . 0.0 110.027 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.466 HD22 ' HB3' ' A' ' 567' ' ' GLU . 10.4 mt -75.83 176.92 7.35 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.18 175.15 5.56 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.383 173.553 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.72 -42.31 97.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.47 -51.0 11.47 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.913 0.758 . . . . 0.0 108.977 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 567' ' ' GLU . . . . . 0.466 ' HB3' HD22 ' A' ' 563' ' ' LEU . 2.9 mp0 -59.16 -31.23 68.79 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 120.601 -1.312 . . . . 0.0 112.624 177.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.48 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -70.81 -33.28 70.55 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.997 -1.065 . . . . 0.0 109.735 174.785 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.57 -37.83 80.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 117.74 -1.124 . . . . 0.0 109.251 176.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.45 -41.52 14.02 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.983 1.265 . . . . 0.0 109.931 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 554' ' ' LEU . 3.0 mt -62.42 -40.81 97.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.737 -1.227 . . . . 0.0 113.585 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -45.54 91.32 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.82 -30.55 70.76 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 123.773 0.67 . . . . 0.0 110.305 -177.122 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.7 -36.24 62.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.39 1.476 . . . . 0.0 111.312 174.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -66.15 -34.79 78.84 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.165 -1.584 . . . . 0.0 110.435 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -30.85 63.79 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.459 176.374 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -67.13 -41.92 85.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.662 1.585 . . . . 0.0 111.045 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 28.7 mt . . . . . 0 N--CA 1.475 0.783 0 CA-C-N 119.301 0.955 . . . . 0.0 111.884 177.926 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -63.66 -32.73 74.3 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 116.065 -1.922 . . . . 0.0 110.001 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.98 -53.14 46.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 CA-C-N 119.965 1.257 . . . . 0.0 108.749 174.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -44.5 70.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.029 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.417 HG22 HD13 ' A' ' 519' ' ' LEU . 93.1 mt -69.98 -53.77 22.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.41 -36.21 83.62 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.462 1.029 . . . . 0.0 113.313 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.42 HD21 HG21 ' A' ' 525' ' ' ILE . 53.3 mt -70.07 -39.08 75.84 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 117.575 0.687 . . . . 0.0 109.657 174.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.22 -37.68 86.32 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.699 0.681 . . . . 0.0 109.967 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 459' ' ' VAL . . . . . 0.419 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 4.1 t -59.18 -51.84 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.474 1.11 . . . . 0.0 109.118 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -75.29 -20.19 59.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.106 0.562 . . . . 0.0 111.248 -176.074 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -141.94 80.31 15.62 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 126.436 1.894 . . . . 0.0 110.094 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.62 -23.73 74.8 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.779 1.653 . . . . 0.0 113.612 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -64.36 -12.78 45.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.33 0.968 . . . . 0.0 112.921 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.507 HD22 ' CD2' ' A' ' 535' ' ' PHE . 34.2 mt -64.08 -16.23 61.29 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.673 -1.267 . . . . 0.0 109.564 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.46 -28.38 69.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.834 0.854 . . . . 0.0 110.873 173.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.9 m -83.86 -14.57 50.87 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.029 0.832 . . . . 0.0 112.15 173.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -92.75 -8.71 43.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 119.389 0.995 . . . . 0.0 111.755 176.486 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 489' ' ' VAL . 6.0 p -81.03 149.01 65.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 CA-C-N 120.406 1.457 . . . . 0.0 109.333 178.15 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.48 170.13 20.09 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.501 2.801 . . . . 0.0 111.446 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -72.6 10.83 0.92 Allowed 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.686 2.924 . . . . 0.0 114.073 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.527 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.8 mp 74.73 26.45 1.39 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 128.236 2.615 . . . . 0.0 115.088 173.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -55.57 -16.5 4.04 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -175.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.07 16.46 8.48 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.72 1.208 . . . . 0.0 111.555 -178.105 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.608 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 4.5 mp -122.88 -56.45 1.76 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.424 1.09 . . . . 0.0 109.156 -173.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 475' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' A' ' 477' ' ' ASN . 1.3 t70 50.1 24.03 1.3 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.418 1.887 . . . . 0.0 113.106 178.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 53.67 -11.66 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 1 C-N-CA 133.52 4.728 . . . . 0.0 114.169 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 477' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 475' ' ' ASP . 25.6 t30 -88.08 -35.08 17.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 131.512 3.925 . . . . 0.0 111.164 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -75.07 -9.29 58.4 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.552 1.524 . . . . 0.0 110.759 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.616 ' HG ' HD21 ' A' ' 546' ' ' LEU . 12.6 mt -135.79 96.19 13.44 Favored Pre-proline 0 N--CA 1.452 -0.332 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -71.3 82.13 1.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.8 2.333 . . . . 0.0 110.115 -177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 143.99 -17.03 2.16 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.792 1.663 . . . . 0.0 113.353 -174.179 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 479' ' ' LEU . 2.2 tm? -67.89 -25.05 65.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.931 1.865 . . . . 0.0 109.928 174.302 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.26 -41.87 8.66 Favored Glycine 0 C--O 1.217 -0.927 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -46.31 87.46 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 118.906 1.353 . . . . 0.0 112.158 177.147 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -61.52 -49.93 74.73 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.56 0.744 . . . . 0.0 109.752 175.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.75 -49.97 70.89 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.183 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -56.74 -46.93 81.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.43 HD11 HD21 ' A' ' 516' ' ' LEU . 11.4 mt -56.42 -51.47 68.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.001 0.92 . . . . 0.0 111.518 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 468' ' ' VAL . 41.6 t -58.28 -44.31 87.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 119.486 1.039 . . . . 0.0 110.444 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -60.9 -45.53 94.24 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.455 1.502 . . . . 0.0 108.924 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 19.7 m -62.01 -42.77 99.52 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.496 1.518 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 81.1 m -64.96 -41.79 95.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 120.756 1.616 . . . . 0.0 110.816 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.3 -22.07 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.504 1.122 . . . . 0.0 111.978 174.504 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 19.8 t -88.65 -39.08 14.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.671 1.188 . . . . 0.0 111.286 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -76.19 105.51 2.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.249 1.02 . . . . 0.0 109.775 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.83 117.57 5.18 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 121.865 1.71 . . . . 0.0 110.513 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 71.05 35.12 64.6 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 177.799 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.449 HD21 HD13 ' A' ' 503' ' ' LEU . 21.4 tp -56.83 158.28 4.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.612 0.765 . . . . 0.0 111.17 175.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.62 168.92 18.37 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.603 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -50.48 -51.21 49.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.204 1.402 . . . . 0.0 110.686 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.79 -39.48 33.77 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -176.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -64.67 -25.45 67.95 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.307 0.643 . . . . 0.0 111.48 -177.572 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.449 HD13 HD21 ' A' ' 498' ' ' LEU . 57.3 tp -59.93 -52.52 65.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.562 0.745 . . . . 0.0 109.408 174.055 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.617 HD21 ' HA ' ' A' ' 517' ' ' GLU . 8.9 mp -62.95 -37.49 87.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.148 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.32 -39.1 85.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.11 0.564 . . . . 0.0 111.232 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -64.69 -20.52 66.36 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -114.9 16.47 17.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.444 1.497 . . . . 0.0 109.817 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -52.37 125.62 16.65 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.123 -1.61 . . . . 0.0 110.072 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 80.36 11.34 84.33 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.883 -0.954 . . . . 0.0 113.916 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.79 HG22 ' H ' ' A' ' 512' ' ' ASN . 35.2 m -93.27 147.4 22.95 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 120.133 1.966 . . . . 0.0 108.448 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.09 -15.63 46.54 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 177.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.79 ' H ' HG22 ' A' ' 510' ' ' THR . 0.1 OUTLIER -92.3 -17.85 24.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.694 1.598 . . . . 0.0 112.403 173.921 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.33 -38.27 68.51 Favored 'General case' 0 C--O 1.198 -1.654 0 C-N-CA 124.581 1.152 . . . . 0.0 110.466 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.14 -46.24 65.32 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 122.755 0.422 . . . . 0.0 110.618 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 97.7 m -61.58 -48.67 79.91 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.015 -1.053 . . . . 0.0 109.949 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 488' ' ' LEU . 94.9 mt -61.81 -40.66 96.02 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.678 0.791 . . . . 0.0 111.864 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.617 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.9 tt0 -62.8 -45.83 90.82 Favored 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.805 1.642 . . . . 0.0 108.532 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -63.32 -30.06 71.26 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.234 -0.889 . . . . 0.0 112.066 174.536 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.417 HD13 HG22 ' A' ' 455' ' ' ILE . 22.3 mt -85.37 -14.45 46.32 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.857 1.208 . . . . 0.0 113.237 176.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.8 t -75.01 -54.83 6.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.654 1.182 . . . . 0.0 108.175 177.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -74.53 13.01 0.67 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.068 2.147 . . . . 0.0 113.589 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -82.81 97.28 8.54 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.824 1.25 . . . . 0.0 113.265 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.0 14.11 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 129.134 2.973 . . . . 0.0 112.526 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -61.13 -25.07 66.73 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.425 1.89 . . . . 0.0 111.375 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.42 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -110.73 -48.55 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 127.683 2.393 . . . . 0.0 111.358 176.586 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.411 ' H ' HG12 ' A' ' 525' ' ' ILE . . . 52.31 20.51 1.41 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.119 2.568 . . . . 0.0 115.629 177.795 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -137.74 172.14 13.39 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.728 -1.232 . . . . 0.0 110.492 -173.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -124.29 -16.49 6.4 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.076 1.35 . . . . 0.0 113.844 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.36 -53.36 4.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.849 2.46 . . . . 0.0 107.756 175.093 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.34 -25.91 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.383 175.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.92 -59.52 4.05 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.962 1.305 . . . . 0.0 111.185 174.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.6 -44.08 80.77 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.05 0.841 . . . . 0.0 111.04 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -51.67 64.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.643 0.777 . . . . 0.0 109.793 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 53.1 m -66.36 -30.49 70.9 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.151 1.38 . . . . 0.0 110.825 -176.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.507 ' CD2' HD22 ' A' ' 464' ' ' LEU . 81.2 t80 -64.54 -56.18 15.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 176.003 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 98.2 m -59.46 -38.03 79.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.666 0.786 . . . . 0.0 111.258 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.11 -47.55 79.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.495 1.141 . . . . 0.0 111.237 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 24.5 t -65.62 -43.35 89.8 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 120.788 -1.195 . . . . 0.0 111.581 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.8 -50.28 63.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 118.989 0.813 . . . . 0.0 109.906 174.971 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -57.27 -43.97 83.55 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 123.346 0.658 . . . . 0.0 109.794 175.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.73 -40.61 88.44 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 119.312 0.96 . . . . 0.0 111.873 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.72 -51.89 67.69 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.33 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.608 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.0 m-85 -64.73 -41.97 95.56 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.867 0.867 . . . . 0.0 111.316 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.6 -49.73 74.04 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.344 2.258 . . . . 0.0 109.136 174.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 17.4 t -56.78 -43.79 81.21 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 123.471 0.708 . . . . 0.0 110.591 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.616 HD21 ' HG ' ' A' ' 479' ' ' LEU . 27.8 mt -68.45 -37.25 80.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.768 1.167 . . . . 0.0 110.358 -177.076 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 72.0 mt -70.27 -41.6 73.23 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.673 -0.68 . . . . 0.0 109.901 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.36 -50.82 68.43 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.347 1.459 . . . . 0.0 109.546 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.47 -47.14 73.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.072 0.949 . . . . 0.0 109.308 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -57.95 -44.84 87.22 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.303 0.956 . . . . 0.0 110.909 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -52.82 36.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.251 1.02 . . . . 0.0 109.87 173.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.08 -43.18 96.19 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.848 0.749 . . . . 0.0 110.53 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' GLU . . . . . 0.402 ' CG ' HH22 ' A' ' 557' ' ' ARG . 1.5 tp10 -59.98 -39.13 84.65 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.802 1.241 . . . . 0.0 110.096 -175.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.63 -53.28 56.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.561 1.544 . . . . 0.0 109.379 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 42.8 mm -60.58 -36.33 69.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-N 119.393 0.997 . . . . 0.0 110.93 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.0 -21.5 66.52 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.217 -1.552 . . . . 0.0 111.724 176.58 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 557' ' ' ARG . . . . . 0.402 HH22 ' CG ' ' A' ' 553' ' ' GLU . 4.2 ttm105 -84.57 -10.67 57.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 115.632 -2.128 . . . . 0.0 111.377 173.772 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -64.36 0.95 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 121.093 1.769 . . . . 0.0 110.257 174.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -71.56 3.23 4.11 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.816 1.247 . . . . 0.0 114.144 -173.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 46.8 p -118.72 -51.11 2.38 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.612 1.165 . . . . 0.0 111.343 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -50.56 2.83 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.734 1.214 . . . . 0.0 111.163 -174.434 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 123.5 131.91 3.86 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 126.29 1.9 . . . . 0.0 109.712 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.8 mt -86.56 137.85 32.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 6.3 t -68.86 167.3 15.9 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.224 1.012 . . . . 0.0 110.408 173.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -42.75 84.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.508 175.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -48.77 58.36 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 124.591 1.156 . . . . 0.0 109.823 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -60.7 -38.82 86.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.409 0.684 . . . . 0.0 110.858 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -62.48 -35.6 79.84 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.38 -0.825 . . . . 0.0 109.629 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 6.2 mp -71.96 -43.15 65.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 117.14 -1.41 . . . . 0.0 110.881 173.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -51.99 -37.49 53.36 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.469 1.031 . . . . 0.0 109.522 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.8 mt -62.9 -42.12 99.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 116.608 -1.663 . . . . 0.0 113.483 174.405 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -58.39 -44.96 89.17 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 121.37 1.896 . . . . 0.0 108.482 175.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -48.61 76.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -175.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.2 -42.11 98.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.74 1.216 . . . . 0.0 111.373 177.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -57.35 -45.36 84.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.365 0.666 . . . . 0.0 109.333 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -73.25 -27.45 61.59 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.135 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.09 -36.86 80.48 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.667 1.587 . . . . 0.0 109.564 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.4 mt . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 123.799 0.84 . . . . 0.0 111.805 177.618 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.9 ptt? . . . . . 0 C--O 1.224 -0.243 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.96 -21.98 65.95 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 116.907 -1.52 . . . . 0.0 111.046 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.523 HD13 HG21 ' A' ' 525' ' ' ILE . 0.5 OUTLIER -53.1 -48.74 52.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 C-N-CA 126.181 1.792 . . . . 0.0 109.453 173.369 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 32.6 mt -53.5 -45.08 69.53 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 118.657 0.662 . . . . 0.0 109.906 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.559 HG23 HD13 ' A' ' 488' ' ' LEU . 95.7 mt -72.18 -51.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.341 176.204 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -65.04 -32.43 84.13 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-N 121.431 1.923 . . . . 0.0 113.373 -173.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.422 ' CD1' HG23 ' A' ' 453' ' ' ILE . 71.4 mt -70.39 -40.22 74.07 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.17 174.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -34.44 77.82 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.932 1.293 . . . . 0.0 109.99 174.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 16.4 t -60.65 -58.65 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 500' ' ' THR . 32.8 mt-30 -71.77 -22.32 61.61 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.19 -177.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.462 ' HB3' HD12 ' A' ' 464' ' ' LEU . 12.1 t-20 -135.44 77.53 53.13 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 127.051 2.141 . . . . 0.0 108.455 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.08 -13.67 36.81 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 121.311 1.341 . . . . 0.0 112.485 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -70.49 -19.79 62.9 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.725 0.81 . . . . 0.0 111.323 173.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.462 HD12 ' HB3' ' A' ' 461' ' ' ASN . 36.0 mt -62.96 -15.66 56.69 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.399 1.454 . . . . 0.0 110.571 175.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.505 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -64.65 -30.97 72.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 119.36 0.982 . . . . 0.0 110.832 174.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.1 m -74.84 -19.48 60.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.997 0.817 . . . . 0.0 110.792 174.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 25.1 mt -91.0 -22.56 20.74 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 120.865 -1.147 . . . . 0.0 110.798 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -70.06 156.34 91.96 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 118.947 0.794 . . . . 0.0 110.244 179.299 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.673 ' HD2' HG22 ' A' ' 468' ' ' VAL . 23.0 Cg_endo -74.74 174.01 13.42 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 124.475 3.45 . . . . 0.0 112.448 176.937 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -76.71 12.04 1.77 Allowed 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 121.698 1.599 . . . . 0.0 113.519 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.564 HD22 ' HG3' ' A' ' 486' ' ' ARG . 10.2 mp 64.54 46.86 3.11 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.766 2.426 . . . . 0.0 112.428 176.259 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.03 -42.12 60.78 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -105.68 17.76 23.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.765 1.226 . . . . 0.0 111.053 -175.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.618 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.5 mm? -97.64 -77.56 0.5 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -173.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 31.3 t0 64.41 141.42 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.258 2.223 . . . . 0.0 112.781 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -68.44 -20.06 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 120.997 -1.065 . . . . 0.0 109.547 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -62.31 -45.61 92.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.93 1.292 . . . . 0.0 110.285 173.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -80.62 -35.74 33.6 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 121.661 -0.649 . . . . 0.0 110.124 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 546' ' ' LEU . 2.4 mm? -121.37 103.58 41.45 Favored Pre-proline 0 CA--C 1.534 0.344 0 C-N-CA 124.032 0.933 . . . . 0.0 108.876 -176.605 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.11 -20.45 33.19 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.544 1.496 . . . . 0.0 112.356 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.9 -8.9 61.47 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.703 -1.054 . . . . 0.0 112.742 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -32.33 71.05 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 116.256 -1.831 . . . . 0.0 109.721 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.46 -48.73 16.36 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.572 1.533 . . . . 0.0 111.238 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.68 -44.89 95.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.836 -0.803 . . . . 0.0 111.692 175.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 57.4 t80 -64.37 -48.79 74.15 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 119.115 0.871 . . . . 0.0 111.718 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.564 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.3 OUTLIER -54.23 -53.63 51.0 Favored 'General case' 0 CA--C 1.504 -0.811 0 C-N-CA 125.272 1.429 . . . . 0.0 108.186 175.737 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.07 -41.58 92.72 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.629 1.104 . . . . 0.0 110.872 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.559 HD13 HG23 ' A' ' 455' ' ' ILE . 3.4 mt -56.42 -56.86 15.88 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.136 0.974 . . . . 0.0 110.158 173.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 468' ' ' VAL . 53.5 t -58.7 -46.34 90.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.428 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -55.97 -46.45 78.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 125.779 1.632 . . . . 0.0 108.755 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 24.0 m -62.15 -44.13 97.3 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 125.81 1.644 . . . . 0.0 111.072 174.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.19 -37.12 86.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.069 0.849 . . . . 0.0 110.594 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -28.42 70.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.003 1.321 . . . . 0.0 109.679 174.329 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.67 -57.09 4.0 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.26 -0.9 . . . . 0.0 110.329 174.585 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -61.03 108.59 1.55 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.604 1.162 . . . . 0.0 110.241 -175.058 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -73.81 141.02 29.83 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 122.238 1.959 . . . . 0.0 109.398 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 50.24 33.58 23.59 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.097 1.332 . . . . 0.0 111.873 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 36.8 tp -54.03 156.3 3.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.976 1.37 . . . . 0.0 109.651 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 499' ' ' THR . . . . . 0.404 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.2 p -135.05 163.77 29.13 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.537 HG23 ' HA ' ' A' ' 460' ' ' GLN . 8.3 m -50.84 -46.97 60.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 125.593 1.557 . . . . 0.0 110.468 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.93 -41.6 27.38 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.404 ' HB3' ' H ' ' A' ' 499' ' ' THR . 28.1 tp60 -62.33 -24.67 67.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.609 -0.936 . . . . 0.0 110.459 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 40.9 tp -68.37 -45.36 72.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 119.606 1.094 . . . . 0.0 108.902 174.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.66 -38.62 85.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.608 -0.711 . . . . 0.0 111.012 175.677 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.26 -39.35 82.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.126 0.571 . . . . 0.0 111.355 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -66.98 -20.46 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 120.539 -1.35 . . . . 0.0 112.144 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -111.35 15.05 21.55 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.476 1.11 . . . . 0.0 109.931 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -54.63 128.59 33.09 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 119.985 -1.697 . . . . 0.0 110.173 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 76.7 15.42 81.6 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.272 -0.738 . . . . 0.0 114.108 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.83 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.7 m -93.98 145.95 24.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.885 1.343 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -59.41 -22.87 62.06 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.025 -1.047 . . . . 0.0 111.427 174.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.83 ' H ' HG22 ' A' ' 510' ' ' THR . 0.9 OUTLIER -92.63 -13.95 28.83 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 123.786 0.835 . . . . 0.0 112.533 178.593 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.29 -43.23 74.58 Favored 'General case' 0 C--O 1.209 -1.028 0 O-C-N 123.558 0.536 . . . . 0.0 109.735 173.55 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.46 -43.51 75.56 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 112.624 177.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 87.3 m -63.24 -50.06 71.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.376 -0.827 . . . . 0.0 109.141 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.516 HD21 HD11 ' A' ' 488' ' ' LEU . 48.7 mt -58.74 -42.15 88.11 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.565 0.746 . . . . 0.0 112.399 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.74 -42.74 81.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.304 1.842 . . . . 0.0 108.608 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -59.15 -30.68 68.33 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.515 -0.755 . . . . 0.0 111.01 173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 56.3 mt -89.29 -3.86 58.35 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.19 0.905 . . . . 0.0 111.913 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.0 t -79.1 -50.48 10.97 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.117 1.367 . . . . 0.0 109.396 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.57 9.77 8.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.408 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' A' ' 525' ' ' ILE . 3.2 t90 -59.97 112.67 1.96 Allowed 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 125.556 1.542 . . . . 0.0 115.01 -173.321 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.96 -29.22 49.69 Favored 'General case' 0 C--N 1.326 -0.432 1 C-N-CA 131.76 4.024 . . . . 0.0 114.389 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -53.81 -27.31 28.57 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.224 1.81 . . . . 0.0 112.786 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.523 HG21 HD13 ' A' ' 453' ' ' ILE . 1.2 pt -123.53 -66.88 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 C-N-CA 124.673 1.189 . . . . 0.0 110.472 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.23 42.32 13.29 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.243 1.417 . . . . 0.0 114.005 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.58 172.13 13.24 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.856 -1.152 . . . . 0.0 111.4 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.44 -27.96 3.39 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.938 2.095 . . . . 0.0 111.906 175.32 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -80.9 -54.48 5.55 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.413 1.085 . . . . 0.0 108.513 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.84 -15.0 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 124.721 1.208 . . . . 0.0 109.598 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.417 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -61.41 -60.95 2.93 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 119.969 1.259 . . . . 0.0 110.746 173.879 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -55.96 -40.72 73.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.912 0.778 . . . . 0.0 111.31 -177.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -53.1 54.52 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.194 -0.316 . . . . 0.0 111.541 177.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 86.4 m -63.78 -27.39 69.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.184 0.993 . . . . 0.0 110.758 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.462 ' CD2' HD22 ' A' ' 464' ' ' LEU . 54.6 t80 -67.72 -53.25 28.97 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 120.173 1.351 . . . . 0.0 107.684 178.072 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 72.9 m -66.22 -39.09 89.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.291 -0.862 . . . . 0.0 111.213 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.38 -44.33 97.35 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.612 1.097 . . . . 0.0 109.614 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 t -61.22 -55.11 35.82 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 120.954 -1.091 . . . . 0.0 110.604 176.104 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.12 -44.34 79.04 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 125.009 1.323 . . . . 0.0 108.831 -178.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.01 -44.0 98.06 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.353 0.979 . . . . 0.0 110.428 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -67.55 -40.75 84.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.891 0.769 . . . . 0.0 111.539 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.2 mmt -59.44 -53.1 62.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 121.14 -0.975 . . . . 0.0 109.504 173.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.618 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.6 m-85 -59.69 -45.09 93.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.545 0.738 . . . . 0.0 111.428 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -57.67 -46.76 83.83 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.051 1.34 . . . . 0.0 109.807 177.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.7 t -56.15 -39.12 71.8 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.484 0.714 . . . . 0.0 110.893 174.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 479' ' ' LEU . 38.2 mt -73.89 -35.04 64.65 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 120.675 -1.266 . . . . 0.0 110.819 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.8 -43.6 79.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.661 1.185 . . . . 0.0 108.737 175.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.49 -53.58 56.53 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.554 1.142 . . . . 0.0 110.571 174.103 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 56.5 mt -57.41 -43.21 83.56 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.815 -0.553 . . . . 0.0 110.325 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -59.29 -44.06 92.52 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 117.231 -1.366 . . . . 0.0 109.464 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.38 -50.74 66.8 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 119.329 0.968 . . . . 0.0 110.209 176.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -44.92 89.14 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.675 -0.678 . . . . 0.0 110.039 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -41.42 96.19 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.159 0.984 . . . . 0.0 109.769 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 10.7 mt -60.85 -52.46 64.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.602 1.561 . . . . 0.0 108.909 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.419 HD13 HD13 ' A' ' 571' ' ' LEU . 47.3 mm -61.62 -36.27 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-N 119.967 1.258 . . . . 0.0 111.162 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.47 -24.88 66.88 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.277 -1.514 . . . . 0.0 110.745 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -84.65 -7.03 59.38 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 115.808 -2.044 . . . . 0.0 111.659 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.13 -60.33 2.56 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 122.54 2.427 . . . . 0.0 106.525 173.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -76.08 -4.4 41.23 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.301 -1.499 . . . . 0.0 113.99 -173.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -114.88 -63.67 1.42 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 121.171 1.805 . . . . 0.0 109.884 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -74.89 -44.51 48.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.538 1.135 . . . . 0.0 111.499 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 111.99 3.98 26.17 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 116.339 -2.367 . . . . 0.0 113.65 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 4.1 mt 41.17 -159.05 0.01 OUTLIER 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 127.866 2.467 . . . . 0.0 110.915 -173.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 29.6 t -139.33 160.23 40.32 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -40.17 74.07 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.3 -52.09 13.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.884 0.874 . . . . 0.0 109.603 -178.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.96 -36.54 75.0 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.297 0.953 . . . . 0.0 111.325 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 17.8 ttt85 -61.83 -32.58 72.91 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.128 -1.608 . . . . 0.0 111.138 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 85.9 mt -80.71 -33.44 35.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.954 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -53.36 -46.1 69.44 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 555' ' ' ILE . 5.5 mt -56.45 -40.5 74.92 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 116.868 -1.539 . . . . 0.0 113.605 174.435 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.33 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 122.405 2.366 . . . . 0.0 109.071 175.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 2.8 m -62.31 -47.61 83.5 Favored 'General case' 0 CA--C 1.528 0.112 0 O-C-N 125.114 1.509 . . . . 0.0 107.215 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.28 87.24 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.712 -1.242 . . . . 0.0 111.001 177.236 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -65.08 -37.14 86.55 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.041 -1.037 . . . . 0.0 111.184 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -75.53 -25.38 57.14 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.679 -1.153 . . . . 0.0 110.364 175.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -45.58 77.6 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.416 1.007 . . . . 0.0 108.339 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 N--CA 1.471 0.584 0 C-N-CA 124.782 1.233 . . . . 0.0 112.844 179.294 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 121.193 0.521 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 71.2 mtt-85 -56.76 -27.64 59.81 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 115.513 -2.184 . . . . 0.0 109.978 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.8 mm -64.77 -53.22 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 119.858 1.208 . . . . 0.0 108.861 174.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.458 HD23 ' CE1' ' A' ' 535' ' ' PHE . 11.6 mt -59.44 -46.8 87.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.394 0.997 . . . . 0.0 110.147 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.647 ' CG2' HD13 ' A' ' 519' ' ' LEU . 15.7 mt -68.29 -57.87 7.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.999 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.973 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 456' ' ' GLY . . . . . 0.508 ' HA3' ' CE3' ' A' ' 522' ' ' TRP . . . -52.62 -42.52 58.4 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 126.285 1.898 . . . . 0.0 111.577 -178.318 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.883 HD21 HG21 ' A' ' 525' ' ' ILE . 97.4 mt -68.26 -44.25 76.0 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-O 117.693 -1.146 . . . . 0.0 109.686 173.662 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 458' ' ' LEU . 3.4 tm? -59.78 -30.78 69.12 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.626 1.103 . . . . 0.0 110.893 175.735 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.11 -49.94 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -74.96 -18.89 60.31 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.484 0.659 . . . . 0.0 111.922 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.751 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.6 t-20 -137.56 83.82 24.43 Favored Pre-proline 0 N--CA 1.44 -0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 107.862 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 23.8 Cg_endo -68.51 -19.86 42.15 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.596 1.531 . . . . 0.0 111.852 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.03 -28.54 70.16 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.214 173.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.817 HD22 ' CD2' ' A' ' 535' ' ' PHE . 15.8 mt -59.87 -16.98 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.609 -1.307 . . . . 0.0 111.766 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.711 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -60.08 -27.47 67.01 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.85 -0.531 . . . . 0.0 111.221 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 -16.51 49.56 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 120.139 -1.601 . . . . 0.0 112.847 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' LEU . . . . . 0.58 HD12 HD23 ' A' ' 464' ' ' LEU . 8.3 mt -85.16 -18.57 33.73 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.777 1.231 . . . . 0.0 108.827 175.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -66.87 148.63 98.78 Favored Pre-proline 0 N--CA 1.439 -0.99 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.782 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.668 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.6 Cg_endo -73.95 179.43 5.72 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 122.099 1.866 . . . . 0.0 111.04 178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -79.72 14.45 1.85 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.826 3.018 . . . . 0.0 112.208 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.541 HD13 HD12 ' A' ' 474' ' ' LEU . 0.3 OUTLIER 69.09 70.35 0.27 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 126.375 1.87 . . . . 0.0 107.693 174.412 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -105.39 -57.79 1.99 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.062 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -80.79 11.93 3.56 Favored 'General case' 0 CA--C 1.498 -1.046 0 C-N-CA 123.565 0.746 . . . . 0.0 112.491 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.841 HD13 HD21 ' A' ' 482' ' ' LEU . 36.8 mt -119.59 -49.99 2.33 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.915 0.886 . . . . 0.0 111.389 -173.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.4 t70 46.39 25.45 0.38 Allowed 'General case' 0 C--N 1.363 1.184 0 C-N-CA 128.6 2.76 . . . . 0.0 111.165 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 40.9 26.39 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 129.378 3.071 . . . . 0.0 112.874 -175.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -135.1 15.6 3.51 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 131.377 3.871 . . . . 0.0 111.607 -177.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.521 ' HB3' HD22 ' A' ' 546' ' ' LEU . 5.4 mmpt? -97.49 -42.76 7.56 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.591 174.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 482' ' ' LEU . 2.1 mm? -121.98 145.47 43.78 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -72.5 5.67 2.7 Favored 'Trans proline' 0 N--CA 1.477 0.544 0 C-N-CA 123.314 2.676 . . . . 0.0 114.258 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -125.32 -11.28 4.25 Favored Glycine 0 N--CA 1.44 -1.074 0 CA-C-O 116.752 -2.138 . . . . 0.0 109.593 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 479' ' ' LEU . 0.3 OUTLIER -53.35 -45.08 69.01 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 119.905 1.852 . . . . 0.0 107.565 -178.469 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -50.75 -49.5 40.7 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 176.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 30.2 tp -61.38 -53.19 59.81 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 118.281 1.041 . . . . 0.0 111.085 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 489' ' ' VAL . 12.6 t80 -52.41 -48.08 65.92 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 123.534 0.734 . . . . 0.0 110.865 175.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -59.67 -50.84 72.29 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.74 -44.56 96.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.818 0.847 . . . . 0.0 111.324 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.605 HD11 HD21 ' A' ' 516' ' ' LEU . 4.7 mt -59.17 -45.56 90.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.232 1.013 . . . . 0.0 109.755 177.705 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -65.69 -45.05 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.517 176.216 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.19 -42.85 70.18 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.379 1.071 . . . . 0.0 109.776 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.3 m -71.65 -43.26 66.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.173 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.477 ' HA ' HD22 ' A' ' 498' ' ' LEU . 57.4 m -55.85 -48.41 75.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.776 1.171 . . . . 0.0 109.583 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.1 -21.27 58.99 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 125.85 1.66 . . . . 0.0 110.745 177.276 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.48 5.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.075 0.95 . . . . 0.0 109.791 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -63.12 104.64 0.52 Allowed Pre-proline 0 N--CA 1.468 0.452 0 C-N-CA 125.837 1.655 . . . . 0.0 110.496 -176.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -70.5 133.21 23.71 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 121.328 1.352 . . . . 0.0 110.485 -178.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.79 37.91 52.8 Favored Glycine 0 N--CA 1.469 0.853 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 503' ' ' LEU . 43.3 tp -57.82 156.09 9.37 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.393 0.616 . . . . 0.0 109.935 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.48 168.36 19.08 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -174.417 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.0 m -58.18 -38.03 75.89 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.55 0.74 . . . . 0.0 110.041 173.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.18 -41.38 8.04 Favored Glycine 0 C--N 1.339 0.724 0 O-C-N 120.798 -1.189 . . . . 0.0 110.431 -177.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.496 ' HB3' HD12 ' A' ' 498' ' ' LEU . 39.3 tp60 -60.57 -27.87 68.02 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 117.679 -1.153 . . . . 0.0 109.691 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 498' ' ' LEU . 30.2 tp -64.39 -53.81 42.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 119.601 1.091 . . . . 0.0 109.646 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.3 mm? -61.28 -34.58 75.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.457 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -71.94 -35.46 69.63 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.327 0.651 . . . . 0.0 111.946 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -72.55 -5.21 35.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.089 2.156 . . . . 0.0 111.676 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.598 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 44.0 m-85 -122.83 18.29 10.21 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.864 1.666 . . . . 0.0 109.774 174.058 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.67 134.51 56.88 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 119.525 -1.985 . . . . 0.0 109.292 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 70.53 21.44 77.63 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.023 176.851 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.881 HG22 ' H ' ' A' ' 512' ' ' ASN . 95.3 m -94.43 144.78 25.27 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.341 1.571 . . . . 0.0 108.697 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -63.02 -17.27 62.03 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.469 -0.769 . . . . 0.0 109.11 173.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.881 ' H ' HG22 ' A' ' 510' ' ' THR . 42.8 m-80 -96.95 -20.59 17.99 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 119.318 -2.114 . . . . 0.0 111.246 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 513' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -45.18 -39.78 6.54 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 124.889 1.368 . . . . 0.0 109.278 178.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.48 20.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 111.201 177.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 98.4 m -57.86 -41.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.354 0 O-C-N 120.675 -1.265 . . . . 0.0 110.713 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.605 HD21 HD11 ' A' ' 488' ' ' LEU . 28.8 mt -64.96 -31.62 72.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.808 175.611 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.493 ' HA ' HD11 ' A' ' 504' ' ' LEU . 0.0 OUTLIER -72.94 -45.45 57.97 Favored 'General case' 0 CA--C 1.506 -0.75 0 C-N-CA 125.95 1.7 . . . . 0.0 109.284 -176.174 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -35.73 80.91 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 119.639 -0.825 . . . . 0.0 109.72 175.988 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.647 HD13 ' CG2' ' A' ' 455' ' ' ILE . 48.0 mt -77.69 -13.61 59.85 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 119.079 -0.486 . . . . 0.0 111.86 177.917 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 520' ' ' SER . . . . . 0.517 ' HB2' HD21 ' A' ' 504' ' ' LEU . 10.2 t -76.48 -60.82 2.18 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 126.012 1.725 . . . . 0.0 108.215 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -2.52 14.32 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 177.362 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.601 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.3 t90 -49.49 115.75 1.47 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 123.456 0.703 . . . . 0.0 109.962 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.09 2.76 35.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.925 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -54.87 -23.83 20.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 118.776 0.717 . . . . 0.0 112.411 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.883 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -109.68 -53.73 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 127.469 2.308 . . . . 0.0 109.493 178.878 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.28 47.61 5.63 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.627 1.571 . . . . 0.0 111.159 -178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -161.11 151.05 17.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -174.639 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 -33.44 7.2 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.968 1.707 . . . . 0.0 113.021 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.96 -60.48 2.34 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 126.492 1.917 . . . . 0.0 109.456 177.116 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 87.2 mt -55.26 -29.39 23.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 117.071 -1.443 . . . . 0.0 107.173 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.439 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -46.9 -55.07 8.65 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.256 1.389 . . . . 0.0 111.514 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -56.4 -43.99 79.84 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.193 0.906 . . . . 0.0 110.23 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -48.35 79.43 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.372 177.48 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 40.2 m -64.14 -31.15 72.24 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.358 1.863 . . . . 0.0 108.281 -177.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.817 ' CD2' HD22 ' A' ' 464' ' ' LEU . 41.5 t80 -69.25 -59.28 3.12 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 124.853 1.261 . . . . 0.0 109.807 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -58.38 -40.16 81.57 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.493 178.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.57 -45.19 92.58 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 118.577 0.626 . . . . 0.0 112.151 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.9 t -67.48 -50.95 56.72 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 117.6 -1.191 . . . . 0.0 110.385 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -44.79 72.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.981 1.712 . . . . 0.0 108.567 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.88 -38.69 92.01 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 124.721 1.263 . . . . 0.0 110.532 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -72.42 -39.41 67.9 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 119.146 0.885 . . . . 0.0 109.051 -176.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -59.85 4.43 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 126.198 1.799 . . . . 0.0 107.462 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.643 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.3 m-85 -54.54 -46.47 73.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 125.014 1.446 . . . . 0.0 110.055 -179.25 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -56.97 -48.89 77.32 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.078 0.951 . . . . 0.0 109.254 178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -47.59 67.22 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.521 HD22 ' HB3' ' A' ' 478' ' ' LYS . 20.4 mt -63.8 -45.77 88.16 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.219 -0.3 . . . . 0.0 110.359 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -37.02 73.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.495 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -63.06 -50.15 71.71 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.89 1.276 . . . . 0.0 109.519 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 1.4 mt -60.77 -48.45 81.75 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' ARG . . . . . 0.446 ' O ' HD12 ' A' ' 554' ' ' LEU . 4.1 ttp180 -57.13 -52.99 63.08 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.731 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -50.19 -54.05 23.62 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.725 1.21 . . . . 0.0 108.748 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -58.3 -39.26 78.86 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-O 117.832 -1.08 . . . . 0.0 109.832 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.43 -39.1 75.48 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 120.031 1.287 . . . . 0.0 112.629 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -65.38 -51.9 57.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 176.248 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 555' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 571' ' ' LEU . 28.2 mm -65.65 -36.28 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 123.528 1.632 . . . . 0.0 113.115 -179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -59.84 -28.58 67.61 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 120.519 -1.363 . . . . 0.0 109.973 174.386 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.01 14.0 33.37 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 125.047 1.339 . . . . 0.0 110.983 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 558' ' ' GLU . . . . . 0.523 ' HG3' HD11 ' A' ' 563' ' ' LEU . 19.1 tt0 -100.64 -41.68 6.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 118.987 0.812 . . . . 0.0 109.182 176.981 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -79.48 -14.76 58.68 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.316 -0.865 . . . . 0.0 111.169 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 72.3 p -101.11 -88.51 0.37 Allowed 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -174.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -51.27 48.51 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 125.184 1.552 . . . . 0.0 108.312 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 89.76 79.49 1.34 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.609 1.576 . . . . 0.0 109.243 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.523 HD11 ' HG3' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -41.21 159.34 0.02 OUTLIER 'General case' 0 C--N 1.346 0.431 0 C-N-CA 127.012 2.125 . . . . 0.0 110.867 172.746 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.1 p -59.4 163.02 4.27 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 122.439 1.114 . . . . 0.0 109.776 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 565' ' ' ASN . . . . . 0.509 ' O ' HD23 ' A' ' 569' ' ' LEU . 0.7 OUTLIER -54.96 -42.16 72.02 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 110.742 173.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -62.59 -46.74 86.94 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.365 1.066 . . . . 0.0 110.102 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -64.26 -34.21 77.59 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.178 0.513 . . . . 0.0 111.051 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -37.96 88.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 121.165 -0.96 . . . . 0.0 110.64 176.13 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 569' ' ' LEU . . . . . 0.509 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.8 mm? -67.48 -44.34 78.77 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 117.657 -1.163 . . . . 0.0 108.905 178.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.72 -37.11 58.61 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 118.768 0.713 . . . . 0.0 110.52 179.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.1 mt -60.51 -51.54 69.0 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 115.57 -2.157 . . . . 0.0 112.154 174.414 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.422 ' HD1' HD13 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -45.97 -49.94 15.33 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 121.621 2.009 . . . . 0.0 109.536 174.855 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.95 -32.63 74.44 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.192 1.397 . . . . 0.0 110.628 -177.031 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 574' ' ' LEU . . . . . 0.555 ' CD1' HD12 ' A' ' 578' ' ' LEU . 1.7 tm? -76.43 -43.05 41.88 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.532 1.133 . . . . 0.0 109.255 174.745 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.46 -46.53 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 119.253 -2.155 . . . . 0.0 108.6 -176.221 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.99 71.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.808 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -44.08 81.17 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.093 1.757 . . . . 0.0 107.89 -175.565 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.555 HD12 ' CD1' ' A' ' 574' ' ' LEU . 13.0 mt . . . . . 0 CA--C 1.516 -0.354 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.545 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.76 -39.17 90.77 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.762 -1.589 . . . . 0.0 111.692 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.8 mm -61.27 -53.18 52.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.6 mt -60.07 -45.75 91.86 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.458 1.026 . . . . 0.0 111.282 -175.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.55 -54.06 29.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.74 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -60.8 -32.1 78.08 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 119.741 1.155 . . . . 0.0 112.538 -175.061 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.29 -47.83 63.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 117.677 0.739 . . . . 0.0 109.392 173.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -59.9 -28.05 67.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.489 0.715 . . . . 0.0 111.001 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 40.0 t -68.33 -57.23 9.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.197 0 O-C-N 121.047 -1.033 . . . . 0.0 108.959 173.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.56 -18.48 61.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.735 -0.603 . . . . 0.0 111.665 -174.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -142.53 83.41 11.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 126.483 1.913 . . . . 0.0 109.623 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -70.79 -13.63 32.24 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 121.264 1.309 . . . . 0.0 112.975 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -68.51 -14.26 62.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.755 1.161 . . . . 0.0 110.464 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 67.0 mt -63.4 -13.6 41.45 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.157 -0.965 . . . . 0.0 109.584 173.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.41 -24.31 67.59 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.121 -0.987 . . . . 0.0 110.929 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.8 m -83.64 -13.99 52.95 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.234 0.924 . . . . 0.0 110.908 173.527 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.7 mt -94.8 -14.22 24.88 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.333 1.053 . . . . 0.0 112.047 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 489' ' ' VAL . 9.5 p -91.21 142.83 27.55 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 120.411 1.459 . . . . 0.0 108.869 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -68.61 170.67 14.63 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.05 13.07 0.15 Allowed 'Trans proline' 0 CA--C 1.554 1.512 0 C-N-CA 124.924 3.749 . . . . 0.0 115.213 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 474' ' ' LEU . 1.5 mm? 72.08 46.01 0.36 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.668 2.787 . . . . 0.0 113.359 173.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.39 -83.32 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.714 2.005 . . . . 0.0 111.694 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.13 -2.38 12.82 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 119.882 -1.761 . . . . 0.0 113.48 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.439 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 4.1 mm? -74.8 -76.62 0.14 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.256 1.823 . . . . 0.0 108.214 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 57.1 t0 62.25 131.71 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 124.139 1.923 . . . . 0.0 113.042 -177.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.47 -20.32 65.48 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.995 1.718 . . . . 0.0 110.394 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -73.08 -33.5 65.66 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.731 1.212 . . . . 0.0 110.456 174.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -80.67 -39.35 27.42 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.418 1.463 . . . . 0.0 111.812 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.589 HD21 HD11 ' A' ' 546' ' ' LEU . 1.5 mm? -119.09 118.22 32.94 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.96 2.74 2.84 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.136 1.891 . . . . 0.0 113.576 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -114.9 0.63 22.94 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 118.064 -1.409 . . . . 0.0 111.892 174.038 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 0.426 ' HB2' ' HB2' ' A' ' 479' ' ' LEU . 0.3 OUTLIER -63.48 -47.91 79.84 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 119.158 1.479 . . . . 0.0 108.138 176.744 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -51.53 -49.37 46.27 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 118.765 0.711 . . . . 0.0 112.116 -176.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.43 -47.29 86.72 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.695 -0.886 . . . . 0.0 110.732 177.863 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -65.1 -39.55 93.31 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.249 0.62 . . . . 0.0 111.214 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -60.75 -53.22 60.05 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 126.544 1.938 . . . . 0.0 108.378 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -58.45 -40.99 84.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.857 0.723 . . . . 0.0 110.04 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 516' ' ' LEU . 0.9 OUTLIER -56.14 -57.5 11.9 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.99 0.516 . . . . 0.0 111.704 174.337 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -60.09 -43.8 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 123.859 0.864 . . . . 0.0 110.205 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -57.59 -49.47 76.3 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.321 1.848 . . . . 0.0 109.245 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 96.7 m -58.95 -42.34 89.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.861 1.264 . . . . 0.0 110.758 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.92 -45.0 87.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.524 0.602 . . . . 0.0 109.802 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.89 -23.01 67.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.912 0.885 . . . . 0.0 112.226 174.305 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 6.1 t -86.28 -11.63 51.73 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.247 1.819 . . . . 0.0 113.45 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -133.22 75.47 70.84 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.19 1.796 . . . . 0.0 108.6 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.69 125.27 14.03 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.643 1.562 . . . . 0.0 109.586 -178.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 93.77 9.44 59.84 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.169 -175.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 1.7 tt -62.44 155.14 26.24 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.842 1.321 . . . . 0.0 108.24 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' THR . . . . . 0.5 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.1 p -127.21 169.8 13.09 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 123.85 0.86 . . . . 0.0 110.003 -173.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -50.01 -51.77 39.3 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.323 1.449 . . . . 0.0 109.962 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.22 -38.71 28.81 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -175.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.5 ' HB3' ' H ' ' A' ' 499' ' ' THR . 9.0 tp-100 -63.93 -25.77 68.29 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.73 -0.652 . . . . 0.0 110.728 179.024 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 18.7 tp -63.48 -44.4 94.53 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.417 1.008 . . . . 0.0 111.014 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 520' ' ' SER . 10.0 mp -65.57 -40.8 93.18 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -63.7 -38.3 90.58 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -70.91 -20.67 62.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.092 -1.005 . . . . 0.0 112.947 -179.071 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -106.72 11.94 29.73 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.464 1.106 . . . . 0.0 109.682 174.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.0 ttt180 -56.52 128.71 37.5 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 120.33 -1.481 . . . . 0.0 111.005 -174.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.23 5.93 86.81 Favored Glycine 0 CA--C 1.535 1.291 0 CA-C-O 118.495 -1.17 . . . . 0.0 113.502 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.838 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -93.93 147.18 23.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 119.59 1.695 . . . . 0.0 107.382 -174.508 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -59.4 -17.71 32.75 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 120.691 -1.256 . . . . 0.0 113.328 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.838 ' H ' HG22 ' A' ' 510' ' ' THR . 7.5 m-80 -92.96 -19.47 21.58 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-O 117.756 -1.116 . . . . 0.0 110.973 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -46.27 -50.09 16.54 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.64 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.88 -45.3 64.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 0.0 112.178 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 25.8 m -58.42 -49.66 76.48 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.972 -0.537 . . . . 0.0 110.669 173.37 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 488' ' ' LEU . 35.1 mt -67.6 -35.76 79.59 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 123.788 0.835 . . . . 0.0 111.516 -176.968 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.13 -47.61 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.911 2.084 . . . . 0.0 107.611 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.26 -29.88 70.11 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 117.509 -1.234 . . . . 0.0 112.213 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 81.8 mt -89.44 -10.86 44.83 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.51 1.05 . . . . 0.0 112.263 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 520' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 504' ' ' LEU . 18.3 t -77.64 -54.08 6.81 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.454 1.502 . . . . 0.0 109.819 174.047 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.78 19.1 1.76 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.751 1.221 . . . . 0.0 112.571 -178.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -74.95 102.23 4.72 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 116.816 2.154 . . . . 0.0 116.816 -172.442 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -3.74 18.65 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 129.755 3.222 . . . . 0.0 113.693 178.403 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.91 -20.39 52.96 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.138 -0.976 . . . . 0.0 111.379 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.12 -63.28 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 126.01 1.724 . . . . 0.0 109.701 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 46.27 25.12 0.33 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.807 2.043 . . . . 0.0 115.889 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -126.23 177.11 6.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.036 1.335 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.32 -21.66 2.29 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.32 1.448 . . . . 0.0 112.982 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.22 -56.95 3.11 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.751 2.02 . . . . 0.0 108.036 174.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 43.1 mt -58.51 -31.37 43.31 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.264 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -51.32 -54.17 28.76 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 118.651 0.66 . . . . 0.0 112.251 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.77 -45.98 84.07 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.312 0.505 . . . . 0.0 109.91 -177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.15 -44.74 94.74 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.108 0.563 . . . . 0.0 110.972 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 96.8 m -69.1 -30.81 69.18 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.503 176.049 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -62.13 -55.15 31.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 120.879 1.672 . . . . 0.0 108.698 174.404 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.6 m -60.36 -41.41 93.63 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.055 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.97 -47.32 78.01 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.919 0.781 . . . . 0.0 111.929 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 46.5 t -61.21 -50.01 74.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.499 1.52 . . . . 0.0 111.536 177.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.42 -49.48 72.3 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.152 1.381 . . . . 0.0 110.138 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -58.62 -46.08 87.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 118.193 -0.908 . . . . 0.0 109.735 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -62.34 -40.29 95.89 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 119.313 0.961 . . . . 0.0 110.667 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -52.73 64.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 4.5 m-85 -63.22 -45.6 90.9 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.671 0.788 . . . . 0.0 111.296 -177.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -52.46 -49.04 65.44 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.764 2.426 . . . . 0.0 109.477 175.583 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 10.7 t -60.7 -41.36 95.03 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.146 0.579 . . . . 0.0 111.9 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 479' ' ' LEU . 86.5 mt -67.76 -34.74 77.41 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.681 -1.262 . . . . 0.0 110.788 178.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 77.8 mt -70.82 -39.72 72.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.271 1.428 . . . . 0.0 110.551 176.141 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.06 -48.01 77.89 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.231 1.412 . . . . 0.0 108.865 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.6 -48.03 80.53 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 123.473 0.709 . . . . 0.0 109.575 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -62.26 -42.04 98.98 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.739 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -55.41 -50.08 70.69 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 118.604 -0.713 . . . . 0.0 110.104 173.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.16 90.07 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 119.448 1.022 . . . . 0.0 109.549 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -66.36 -35.89 81.5 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.267 0.556 . . . . 0.0 110.202 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.511 HD12 ' C ' ' A' ' 554' ' ' LEU 0.282 0.2 OUTLIER -77.15 -39.64 48.43 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.332 1.053 . . . . 0.0 111.028 176.991 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.1 mm -66.59 -33.16 61.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 120.965 1.711 . . . . 0.0 108.791 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.05 71.79 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.296 -1.503 . . . . 0.0 110.045 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 13.3 mtp-105 -74.01 -8.24 55.38 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 117.043 -1.456 . . . . 0.0 111.957 173.35 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -61.82 1.82 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 123.144 2.702 . . . . 0.0 111.77 174.188 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -68.04 -18.66 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.108 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 75.1 p -95.98 -88.52 0.27 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -66.7 -56.93 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.575 1.15 . . . . 0.0 112.343 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 127.21 121.26 2.42 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.542 1.544 . . . . 0.0 110.557 -174.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.93 150.9 37.43 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.442 1.121 . . . . 0.0 112.013 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 35.4 t -78.14 164.59 24.84 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.789 1.635 . . . . 0.0 108.231 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.96 -42.04 99.71 Favored 'General case' 0 C--O 1.226 -0.164 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -69.64 -50.43 44.28 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 -176.274 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -60.49 -33.82 73.15 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.86 -0.525 . . . . 0.0 111.382 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 568' ' ' ARG . . . . . 0.512 ' HA ' HD12 ' A' ' 571' ' ' LEU . 52.9 ttt85 -66.22 -34.21 77.5 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.301 -0.875 . . . . 0.0 109.974 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 80.9 mt -73.09 -34.33 66.14 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.638 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -53.92 -36.43 62.74 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.328 0.967 . . . . 0.0 109.305 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 568' ' ' ARG . 6.3 mt -61.71 -39.32 91.08 Favored 'General case' 0 CA--C 1.519 -0.222 0 O-C-N 120.822 -1.174 . . . . 0.0 112.426 175.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -45.88 91.17 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.037 1.744 . . . . 0.0 108.148 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 3.7 m -66.37 -49.55 66.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 123.81 0.694 . . . . 0.0 109.285 -174.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 6.2 tp -55.1 -43.35 73.91 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.171 1.788 . . . . 0.0 111.286 175.123 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -64.56 -39.34 93.57 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.903 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -73.37 -34.15 65.42 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.649 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -67.04 -37.19 83.65 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 119.407 1.003 . . . . 0.0 109.469 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--O 1.242 0.691 0 O-C-N 120.487 -1.383 . . . . 0.0 109.718 -178.975 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 451' ' ' MET . . . . . 0.501 ' O ' HD12 ' A' ' 455' ' ' ILE . 10.1 mtm . . . . . 0 CA--C 1.542 0.672 0 CA-C-O 121.914 0.864 . . . . 0.0 111.626 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -112.06 -55.12 2.55 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 124.698 1.199 . . . . 0.0 108.464 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.7 mm -56.76 -46.81 83.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -54.51 -55.12 32.35 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.378 0.99 . . . . 0.0 110.356 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 1.088 HD13 HD23 ' A' ' 484' ' ' LEU . 23.2 mt -65.34 -49.04 80.86 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.933 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.2 -38.88 96.35 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 124.048 0.833 . . . . 0.0 111.929 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.568 HD22 ' HB1' ' A' ' 531' ' ' ALA . 52.1 mt -66.37 -45.15 81.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.723 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -34.45 71.26 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.99 0.916 . . . . 0.0 111.871 174.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.23 -53.9 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 124.913 1.285 . . . . 0.0 109.942 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -80.63 -20.94 42.02 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 122.141 -0.35 . . . . 0.0 111.32 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.584 ' HB3' HD12 ' A' ' 464' ' ' LEU . 17.7 t-20 -130.07 81.05 69.75 Favored Pre-proline 0 C--N 1.323 -0.549 0 C-N-CA 124.001 0.921 . . . . 0.0 108.993 -173.626 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 462' ' ' PRO . . . . . 0.423 ' HB3' HD23 ' A' ' 498' ' ' LEU . 36.2 Cg_endo -64.56 -22.54 64.93 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.994 1.796 . . . . 0.0 111.21 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.16 -22.58 62.96 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.155 0.982 . . . . 0.0 110.686 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 461' ' ' ASN . 38.8 mt -63.67 -12.11 31.3 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.7 -1.25 . . . . 0.0 111.362 173.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -66.76 -28.05 68.09 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 120.907 -1.12 . . . . 0.0 111.209 174.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 31.9 m -83.65 -21.83 32.34 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.904 0.882 . . . . 0.0 110.906 173.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -14.8 47.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.777 0.717 . . . . 0.0 112.773 175.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 489' ' ' VAL . 5.7 p -77.79 145.48 70.66 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 120.166 1.348 . . . . 0.0 109.21 176.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.556 ' HD2' HD11 ' A' ' 539' ' ' LEU . 13.3 Cg_endo -68.67 170.43 15.24 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.513 2.809 . . . . 0.0 111.483 173.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -74.46 12.92 0.99 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.413 2.742 . . . . 0.0 114.277 175.706 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.639 ' HG ' HD12 ' A' ' 474' ' ' LEU . 6.6 mp 72.46 43.07 0.5 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.153 2.181 . . . . 0.0 112.698 174.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -65.81 -30.76 71.44 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -126.06 17.41 7.85 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.566 1.546 . . . . 0.0 110.536 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.639 HD12 ' HG ' ' A' ' 471' ' ' LEU . 61.3 mt -100.85 -101.68 0.25 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.246 1.019 . . . . 0.0 109.173 178.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.3 t0 70.97 147.15 0.07 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 128.141 2.577 . . . . 0.0 109.979 -173.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.85 -25.85 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.844 1.658 . . . . 0.0 109.622 173.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.16 -33.55 71.04 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 122.969 0.508 . . . . 0.0 111.229 175.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 546' ' ' LEU . 54.9 mttt -92.38 -24.33 18.93 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 112.26 0.466 . . . . 0.0 112.26 176.772 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 546' ' ' LEU . 0.9 OUTLIER -125.84 96.15 38.36 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -177.015 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.16 67.31 4.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.579 2.852 . . . . 0.0 111.394 -174.497 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 163.52 -23.33 0.18 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 127.019 2.247 . . . . 0.0 112.308 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.1 tp -60.66 -23.98 65.23 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.633 -0.922 . . . . 0.0 110.814 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -49.07 -35.26 18.46 Favored Glycine 0 C--O 1.222 -0.655 0 CA-C-N 119.136 0.88 . . . . 0.0 111.326 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' LEU . . . . . 1.088 HD23 HD13 ' A' ' 455' ' ' ILE . 6.4 tp -61.16 -43.44 98.87 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.72 1.26 . . . . 0.0 111.337 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.33 -51.25 61.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 124.572 1.149 . . . . 0.0 110.845 176.233 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -53.84 -50.6 65.85 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.596 0.634 . . . . 0.0 111.12 -178.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -50.91 69.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 117.851 0.296 . . . . 0.0 110.964 174.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 468' ' ' VAL . 73.9 t -62.1 -45.61 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.264 176.367 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -55.61 -46.37 77.34 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.324 1.05 . . . . 0.0 109.353 -176.875 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 95.5 m -61.67 -46.77 88.29 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.178 2.191 . . . . 0.0 110.654 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 69.4 m -63.14 -44.16 96.33 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.155 0.889 . . . . 0.0 110.321 -178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -23.18 64.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.105 1.362 . . . . 0.0 112.085 174.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.28 -51.23 8.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.169 1.388 . . . . 0.0 110.293 177.397 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -71.3 100.48 0.3 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 127.062 2.145 . . . . 0.0 110.504 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.43 115.01 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.287 2.658 . . . . 0.0 111.574 -173.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.58 34.01 54.76 Favored Glycine 0 CA--C 1.522 0.478 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.252 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.633 HD21 HD13 ' A' ' 503' ' ' LEU . 15.9 tp -54.74 154.43 5.06 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.643 0.735 . . . . 0.0 110.242 174.078 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.96 163.98 26.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.2 1.4 . . . . 0.0 108.565 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -52.76 -45.32 67.01 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.911 0.884 . . . . 0.0 110.583 175.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -80.24 -31.96 36.62 Favored Glycine 0 C--N 1.338 0.691 0 CA-C-O 118.899 -0.945 . . . . 0.0 111.081 -176.51 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -40.24 95.71 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 118.363 1.081 . . . . 0.0 108.751 174.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.633 HD13 HD21 ' A' ' 498' ' ' LEU . 16.5 tp -52.93 -53.08 54.75 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.906 0.776 . . . . 0.0 109.562 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.69 -40.72 84.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.102 0.41 . . . . 0.0 111.661 176.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.14 -40.14 96.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.759 0.423 . . . . 0.0 111.078 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -67.4 -20.57 65.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.359 1.464 . . . . 0.0 111.646 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 507' ' ' TYR . . . . . 0.525 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 66.5 m-85 -108.15 17.54 22.17 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.695 1.598 . . . . 0.0 109.217 176.498 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 15.5 ttt180 -59.7 133.88 56.5 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 119.901 -1.749 . . . . 0.0 110.166 -175.52 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 63.43 18.71 61.38 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 121.712 -0.618 . . . . 0.0 113.256 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.811 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.7 m -93.12 140.79 29.13 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -178.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -20.45 16.73 Favored 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.811 ' H ' HG22 ' A' ' 510' ' ' THR . 1.1 m120 -94.16 -19.5 20.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.068 1.347 . . . . 0.0 109.715 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 513' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.98 -45.53 31.65 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -53.75 -43.81 69.44 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.949 1.3 . . . . 0.0 112.1 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.5 m -62.85 -49.82 73.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.562 0.745 . . . . 0.0 109.042 173.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.1 mt -62.16 -35.73 79.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.404 1.081 . . . . 0.0 112.558 -178.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -34.29 62.07 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.583 2.353 . . . . 0.0 108.75 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.2 -43.31 98.51 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 173.348 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 24.4 mt -71.17 -22.39 62.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.548 1.139 . . . . 0.0 110.626 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 41.1 t -62.34 -53.99 46.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 120.744 1.611 . . . . 0.0 109.496 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.82 20.28 4.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.875 1.27 . . . . 0.0 111.397 -175.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -70.57 126.76 30.52 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.386 0.674 . . . . 0.0 111.324 -173.443 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.05 -2.45 37.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.06 1.344 . . . . 0.0 111.424 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -68.74 -27.68 66.14 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.818 -1.176 . . . . 0.0 111.988 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.82 -67.32 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 C-N-CA 126.026 1.731 . . . . 0.0 107.974 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 37.94 52.02 1.46 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.586 1.554 . . . . 0.0 112.14 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -148.27 167.84 24.09 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.947 1.299 . . . . 0.0 109.464 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -120.63 -32.41 4.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.091 2.156 . . . . 0.0 111.597 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -83.38 -55.05 4.54 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.261 1.424 . . . . 0.0 109.413 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.92 -25.89 39.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.256 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.568 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -53.9 -54.03 44.35 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.134 174.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -57.83 -46.03 85.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.19 0.995 . . . . 0.0 110.67 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -66.55 -46.92 74.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.767 -0.583 . . . . 0.0 110.104 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 41.6 m -62.25 -28.05 69.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.513 1.525 . . . . 0.0 110.453 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.467 ' CD1' HD13 ' A' ' 464' ' ' LEU . 43.0 t80 -66.23 -57.66 7.08 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 120.957 1.708 . . . . 0.0 108.641 176.086 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 17.8 m -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.346 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -63.91 -46.81 83.15 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.452 1.024 . . . . 0.0 111.758 177.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 29.3 t -65.72 -48.74 70.94 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.032 1.333 . . . . 0.0 110.59 177.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.556 HD11 ' HD2' ' A' ' 469' ' ' PRO . 2.4 tt -55.27 -52.4 63.54 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-O 117.544 -1.217 . . . . 0.0 109.031 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -59.99 -40.19 88.33 Favored 'General case' 0 C--O 1.214 -0.798 0 O-C-N 124.04 0.838 . . . . 0.0 109.927 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -66.34 -32.8 74.42 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.492 1.042 . . . . 0.0 110.395 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 2.3 ttm -66.92 -58.99 3.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.442 ' CD1' HD21 ' A' ' 474' ' ' LEU . 25.7 m-85 -57.88 -45.16 86.8 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.906 1.283 . . . . 0.0 110.166 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -55.6 -50.52 69.9 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.245 1.818 . . . . 0.0 109.513 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 5.0 t -57.97 -42.09 84.29 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 118.552 0.615 . . . . 0.0 110.187 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 479' ' ' LEU . 17.6 mt -72.57 -35.2 67.89 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.371 0.987 . . . . 0.0 110.519 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 26.5 mt -67.95 -40.0 83.34 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.241 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -62.19 -58.33 8.17 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 126.242 1.817 . . . . 0.0 108.379 174.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.98 -54.83 40.04 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.768 1.627 . . . . 0.0 109.814 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -49.85 76.16 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 124.88 1.272 . . . . 0.0 110.1 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 551' ' ' GLN . . . . . 0.427 ' O ' HD23 ' A' ' 554' ' ' LEU . 0.5 OUTLIER -49.59 -56.02 11.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 116.245 -1.836 . . . . 0.0 108.656 173.634 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -60.3 -35.41 75.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.266 1.393 . . . . 0.0 109.956 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -44.81 88.86 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 121.565 -0.709 . . . . 0.0 111.197 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 571' ' ' LEU 0.267 0.0 OUTLIER -80.07 -44.81 19.4 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.372 177.689 . . . . . . . . 4 4 . 1 . 019 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -39.6 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.942 1.701 . . . . 0.0 108.043 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 556' ' ' ALA . . . . . 0.501 ' O ' HG22 ' A' ' 560' ' ' THR . . . -58.76 -39.43 80.95 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.636 -1.29 . . . . 0.0 109.759 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.51 -13.08 18.12 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 116.014 -1.946 . . . . 0.0 110.01 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 558' ' ' GLU . . . . . 0.584 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -72.47 -58.04 3.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 122.306 2.321 . . . . 0.0 109.256 173.574 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -63.59 -27.69 69.42 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 560' ' ' THR . . . . . 0.502 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.6 t -99.6 -82.4 0.44 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 561' ' ' HIS . . . . . 0.502 ' H ' HG23 ' A' ' 560' ' ' THR . 1.6 t-80 -58.48 -40.95 84.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.049 -1.432 . . . . 0.0 113.798 -173.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 98.21 119.29 4.01 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -174.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 558' ' ' GLU . 1.0 OUTLIER -92.75 152.48 19.46 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 173.431 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.2 t -73.05 165.09 25.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -37.54 74.49 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.451 -0.781 . . . . 0.0 111.385 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -75.61 -53.21 8.95 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 124.532 1.145 . . . . 0.0 110.648 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 567' ' ' GLU . . . . . 0.633 ' O ' HD22 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -58.75 -40.43 83.82 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 118.96 0.8 . . . . 0.0 111.17 177.689 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -59.53 -33.61 71.6 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.138 1.335 . . . . 0.0 109.794 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 19.1 mt -72.36 -37.15 68.87 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 116.715 -1.612 . . . . 0.0 110.068 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.77 -41.1 43.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.841 1.655 . . . . 0.0 109.431 174.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 554' ' ' LEU . 0.8 OUTLIER -68.86 -38.35 79.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.949 -177.801 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -47.25 74.19 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 119.512 1.051 . . . . 0.0 109.018 173.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -52.55 63.51 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 574' ' ' LEU . . . . . 0.412 HD22 ' HG3' ' A' ' 551' ' ' GLN . 7.1 tt -55.43 -36.44 66.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.284 1.434 . . . . 0.0 111.288 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -61.21 -39.76 91.45 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.155 -1.591 . . . . 0.0 111.474 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -78.41 -25.05 45.98 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.857 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -66.99 -38.95 86.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.558 1.143 . . . . 0.0 109.503 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 N--CA 1.475 0.78 0 C-N-CA 124.882 1.273 . . . . 0.0 112.683 173.887 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 451' ' ' MET . . . . . 0.728 ' HE1' HD12 ' A' ' 482' ' ' LEU . 53.2 tpp . . . . . 0 CA--C 1.539 0.541 0 CA-C-O 123.711 1.72 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.01 -51.29 0.23 Allowed 'General case' 0 CA--C 1.486 -1.491 0 CA-C-O 117.007 -1.473 . . . . 0.0 108.848 -175.159 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 453' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 534' ' ' THR . 7.4 mm -58.74 -52.6 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 124.946 1.404 . . . . 0.0 107.709 176.106 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 454' ' ' LEU . . . . . 0.435 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 2.7 mt -56.78 -47.13 80.87 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 118.74 0.7 . . . . 0.0 110.75 -175.149 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 455' ' ' ILE . . . . . 0.403 HG22 HD13 ' A' ' 519' ' ' LEU . 26.5 mt -62.22 -59.31 4.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 C-N-CA 123.851 0.86 . . . . 0.0 111.606 174.296 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.85 -38.14 96.04 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 120.833 1.651 . . . . 0.0 113.233 -173.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 457' ' ' LEU . . . . . 0.96 HD21 HG21 ' A' ' 525' ' ' ILE . 47.2 mt -68.9 -38.16 79.44 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.776 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 458' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 492' ' ' CYS . 2.6 tm? -65.96 -36.02 82.2 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.771 1.169 . . . . 0.0 109.86 173.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.7 t -60.91 -51.6 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 O-C-N 120.561 -1.337 . . . . 0.0 109.041 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.25 -20.24 55.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.719 0.807 . . . . 0.0 112.067 177.413 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' ASN . . . . . 0.512 ' HB3' HD12 ' A' ' 464' ' ' LEU . 9.7 t-20 -134.53 74.69 65.2 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 119.031 0.832 . . . . 0.0 109.316 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 462' ' ' PRO . . . . . 0.583 ' CB ' HD23 ' A' ' 498' ' ' LEU . 24.3 Cg_endo -68.31 -18.52 44.5 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.575 1.516 . . . . 0.0 112.119 -175.163 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -65.84 -15.06 62.55 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.693 1.197 . . . . 0.0 110.857 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 535' ' ' PHE . 43.1 mt -70.31 -12.28 61.48 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 120.437 -1.415 . . . . 0.0 109.01 173.509 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 465' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -58.82 -44.73 90.93 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.944 0.793 . . . . 0.0 109.195 173.479 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.6 m -70.3 -24.73 63.08 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.642 -1.286 . . . . 0.0 112.979 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.2 mt -83.92 -6.02 59.33 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.222 1.809 . . . . 0.0 111.393 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' VAL . . . . . 0.644 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.6 OUTLIER -93.82 157.87 37.38 Favored Pre-proline 0 CA--C 1.547 0.854 0 CA-C-N 121.041 1.746 . . . . 0.0 107.062 177.867 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 469' ' ' PRO . . . . . 0.644 ' HD2' HG22 ' A' ' 468' ' ' VAL . 19.1 Cg_endo -74.69 174.68 12.25 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.199 2.599 . . . . 0.0 111.076 173.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.58 8.73 2.14 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 124.777 3.651 . . . . 0.0 114.215 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' LEU . . . . . 0.875 HD12 HD21 ' A' ' 482' ' ' LEU . 2.2 mm? 63.69 55.22 1.72 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 129.367 3.067 . . . . 0.0 111.919 178.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.22 -39.71 11.39 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.699 0.8 . . . . 0.0 112.383 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -84.22 6.9 20.92 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 120.687 -1.258 . . . . 0.0 113.851 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -128.66 -71.41 0.64 Allowed 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 125.569 1.547 . . . . 0.0 109.622 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 6.5 t70 60.71 162.61 0.06 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-O 122.909 1.338 . . . . 0.0 112.311 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -74.81 -14.63 60.71 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 120.569 -1.332 . . . . 0.0 111.107 178.24 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -63.28 -42.39 99.09 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.766 1.226 . . . . 0.0 109.752 174.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -49.4 22.15 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 118.941 -1.104 . . . . 0.0 108.328 -176.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 479' ' ' LEU . . . . . 1.007 HD23 HD13 ' A' ' 482' ' ' LEU . 0.1 OUTLIER -117.2 118.12 36.11 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.56 -173.778 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -72.3 -2.08 11.14 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.266 1.978 . . . . 0.0 112.614 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -107.0 -7.55 33.01 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.831 1.205 . . . . 0.0 110.621 173.939 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 482' ' ' LEU . . . . . 1.007 HD13 HD23 ' A' ' 479' ' ' LEU . 2.9 tp -63.12 -32.69 74.13 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 116.441 -1.742 . . . . 0.0 108.742 177.883 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -52.4 -48.13 55.16 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 124.392 1.058 . . . . 0.0 110.775 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -44.32 97.0 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 121.547 -0.972 . . . . 0.0 111.928 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 485' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 32.8 t80 -66.19 -42.53 88.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.271 0.628 . . . . 0.0 110.984 177.558 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -64.64 -48.21 75.67 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 116.679 -1.629 . . . . 0.0 107.254 -176.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.25 -44.2 97.08 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 125.497 1.519 . . . . 0.0 109.886 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.508 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -55.47 -53.43 56.38 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.258 0.623 . . . . 0.0 111.005 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 489' ' ' VAL . . . . . 0.608 HG11 HG11 ' A' ' 468' ' ' VAL . 48.4 t -60.59 -46.78 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 116.214 -1.851 . . . . 0.0 110.361 174.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.03 -45.9 82.78 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 121.938 2.154 . . . . 0.0 110.361 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.8 m -62.34 -47.44 84.19 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 126.469 1.908 . . . . 0.0 109.2 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' CYS . . . . . 0.539 ' SG ' HD11 ' A' ' 458' ' ' LEU . 90.7 m -60.28 -38.58 84.03 Favored 'General case' 0 CA--C 1.555 1.152 0 CA-C-N 119.182 0.901 . . . . 0.0 111.854 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 493' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 465' ' ' ALA . 0.7 OUTLIER -60.33 -21.26 61.83 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 129.058 2.943 . . . . 0.0 111.517 175.192 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 23.5 t -89.45 -64.82 1.09 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -57.2 98.4 0.15 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 125.437 1.495 . . . . 0.0 114.124 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -70.48 127.85 14.58 Favored 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.155 1.903 . . . . 0.0 109.963 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 59.77 42.89 98.23 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 498' ' ' LEU . . . . . 0.583 HD23 ' CB ' ' A' ' 462' ' ' PRO . 10.9 tp -56.26 159.53 3.47 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.398 1.094 . . . . 0.0 109.009 174.85 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 499' ' ' THR . . . . . 0.43 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 0.2 OUTLIER -125.4 163.48 22.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 177.772 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.3 m -53.02 -44.5 67.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.781 1.232 . . . . 0.0 109.514 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -73.58 -41.91 42.08 Favored Glycine 0 N--CA 1.442 -0.911 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.43 ' HB3' ' H ' ' A' ' 499' ' ' THR . 4.1 tp-100 -58.93 -31.38 68.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 124.626 1.17 . . . . 0.0 111.849 -176.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 35.4 tp -64.64 -57.35 9.29 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 174.18 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 504' ' ' LEU . . . . . 0.55 HD21 ' HA ' ' A' ' 517' ' ' GLU . 7.9 mp -59.36 -33.17 70.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.236 0.471 . . . . 0.0 112.062 179.479 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.04 -48.46 65.57 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.497 1.119 . . . . 0.0 109.805 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -63.29 -16.48 60.43 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.734 0.813 . . . . 0.0 112.417 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -111.94 16.18 20.43 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.269 1.827 . . . . 0.0 108.969 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -54.86 124.51 16.83 Favored 'General case' 0 C--O 1.227 -0.109 0 O-C-N 120.287 -1.508 . . . . 0.0 108.749 -177.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.77 37.48 61.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.821 -0.433 . . . . 0.0 112.03 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' THR . . . . . 0.826 HG22 ' H ' ' A' ' 512' ' ' ASN . 28.9 m -108.61 152.78 24.32 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.781 1.232 . . . . 0.0 108.737 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -59.75 -25.58 64.98 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.369 1.068 . . . . 0.0 110.591 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 512' ' ' ASN . . . . . 0.826 ' H ' HG22 ' A' ' 510' ' ' THR . 9.7 m120 -92.31 -17.47 24.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 116.02 -1.943 . . . . 0.0 110.181 178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.99 59.3 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 120.016 1.28 . . . . 0.0 109.476 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.25 -45.71 83.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.891 0.769 . . . . 0.0 112.701 -179.171 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 31.1 m -66.93 -44.05 81.67 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.709 -0.62 . . . . 0.0 109.696 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 516' ' ' LEU . . . . . 0.508 HD21 HD11 ' A' ' 488' ' ' LEU . 61.8 mt -59.76 -40.15 87.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.539 1.536 . . . . 0.0 111.607 177.494 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.55 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.3 tt0 -68.49 -42.76 78.19 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 127.019 2.128 . . . . 0.0 109.216 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -61.43 -36.4 80.26 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.525 -0.734 . . . . 0.0 109.625 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 519' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 32.0 mt -82.37 -8.87 59.63 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.978 0.911 . . . . 0.0 112.246 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.9 t -77.5 -56.66 4.35 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 124.956 1.303 . . . . 0.0 108.14 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.8 12.85 1.18 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.947 1.299 . . . . 0.0 113.274 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 522' ' ' TRP . . . . . 0.421 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.9 t90 -68.53 128.44 36.63 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.189 -0.944 . . . . 0.0 110.903 -175.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.66 14.89 15.48 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.711 2.405 . . . . 0.0 110.043 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -65.99 -29.5 69.89 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 120.237 -1.54 . . . . 0.0 109.853 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 525' ' ' ILE . . . . . 0.96 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -107.63 -48.85 8.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 C-N-CA 128.441 2.696 . . . . 0.0 110.363 -179.744 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.81 34.28 0.41 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.253 2.221 . . . . 0.0 112.576 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -157.93 165.68 34.56 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.821 1.649 . . . . 0.0 108.155 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -114.56 -35.58 4.85 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.508 1.523 . . . . 0.0 109.365 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.25 -50.76 64.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.596 0.758 . . . . 0.0 110.051 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 2.3 mm -62.91 -28.5 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.615 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.44 -61.83 2.21 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 119.962 1.255 . . . . 0.0 109.111 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -54.46 -42.55 70.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.865 1.211 . . . . 0.0 110.612 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.05 -55.03 37.44 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 122.691 0.397 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 534' ' ' THR . . . . . 0.508 HG22 HG21 ' A' ' 453' ' ' ILE . 47.8 m -63.47 -31.71 72.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 117.414 -1.279 . . . . 0.0 109.102 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 535' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 464' ' ' LEU . 34.8 t80 -63.16 -54.71 33.45 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.09 1.768 . . . . 0.0 107.676 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 90.8 m -59.84 -48.28 82.32 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.525 0.73 . . . . 0.0 109.551 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -58.22 -46.23 86.26 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.992 1.717 . . . . 0.0 111.666 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 13.2 t -69.12 -45.42 70.2 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 126.824 2.05 . . . . 0.0 111.723 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.5 tt -59.76 -47.26 86.37 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 120.098 1.317 . . . . 0.0 110.753 173.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -59.07 -40.06 84.02 Favored 'General case' 0 C--O 1.207 -1.177 0 O-C-N 120.772 -1.205 . . . . 0.0 113.085 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -64.36 -44.29 91.91 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -52.9 63.67 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 543' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 474' ' ' LEU . 2.9 m-85 -62.29 -40.59 96.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.304 1.041 . . . . 0.0 109.523 -175.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -62.21 -53.81 49.95 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.7 t -51.0 -46.33 61.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.404 1.482 . . . . 0.0 110.817 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.753 HD21 HD11 ' A' ' 479' ' ' LEU . 80.0 mt -69.01 -39.93 79.0 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 119.399 0.999 . . . . 0.0 111.121 -177.423 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.416 ' HB3' HD11 ' A' ' 578' ' ' LEU . 20.2 mt -66.31 -37.29 85.04 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.997 -1.478 . . . . 0.0 110.255 174.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.29 -56.32 13.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.789 2.036 . . . . 0.0 107.818 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 15.6 mt -59.34 -47.1 86.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.66 1.584 . . . . 0.0 108.244 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -47.13 72.54 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 551' ' ' GLN . . . . . 0.461 ' HG3' HD12 ' A' ' 571' ' ' LEU . 27.8 tt0 -50.84 -55.75 15.48 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-O 114.097 -2.859 . . . . 0.0 107.798 175.066 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.08 -44.31 91.87 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 125.811 1.944 . . . . 0.0 110.21 -174.231 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -48.31 74.05 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.71 1.204 . . . . 0.0 109.61 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 554' ' ' LEU . . . . . 1.003 HD11 HD21 ' A' ' 571' ' ' LEU 0.252 0.2 OUTLIER -66.06 -44.33 84.83 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.818 -1.176 . . . . 0.0 109.207 176.236 . . . . . . . . 4 4 . 1 . 020 nuclear build core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.3 mm -64.25 -38.58 82.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 120.567 1.531 . . . . 0.0 108.334 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.28 -38.73 66.2 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.657 1.983 . . . . 0.0 107.624 174.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -2.15 1.85 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 116.659 -1.639 . . . . 0.0 112.582 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 558' ' ' GLU . . . . . 0.55 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.5 OUTLIER -82.92 -27.24 30.76 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.625 1.557 . . . . 0.0 111.338 173.091 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -107.44 -30.28 8.76 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.642 1.11 . . . . 0.0 111.27 -177.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.8 p -77.22 -51.6 10.66 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -114.3 -36.66 4.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.224 1.41 . . . . 0.0 111.829 -176.619 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 102.96 128.4 6.36 Favored Glycine 0 C--N 1.339 0.727 0 C-N-CA 125.574 1.559 . . . . 0.0 110.124 -173.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 563' ' ' LEU . . . . . 0.55 HD12 ' HB2' ' A' ' 558' ' ' GLU . 5.0 mt -87.4 153.23 21.6 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 173.402 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.75 168.52 11.24 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.282 178.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -58.14 -41.45 83.74 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -76.08 -53.61 8.08 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 123.276 0.63 . . . . 0.0 109.786 -178.006 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 567' ' ' GLU . . . . . 0.465 ' HB3' HD22 ' A' ' 563' ' ' LEU . 8.5 mt-10 -60.78 -36.07 78.06 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.907 -177.542 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -59.56 -39.08 82.87 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 120.094 1.315 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 1.5 mp -74.94 -38.24 61.8 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 117.531 -1.223 . . . . 0.0 111.99 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -47.52 -40.8 19.57 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 120.244 1.384 . . . . 0.0 107.875 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 571' ' ' LEU . . . . . 1.003 HD21 HD11 ' A' ' 554' ' ' LEU . 4.5 mm? -72.12 -34.93 68.96 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 115.971 -1.966 . . . . 0.0 110.978 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -48.29 75.82 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 121.109 1.777 . . . . 0.0 107.886 173.096 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -26.27 68.22 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 574' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 578' ' ' LEU . 8.0 tt -81.72 -34.08 30.76 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.556 1.542 . . . . 0.0 109.865 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.67 -44.78 92.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.82 1.648 . . . . 0.0 109.317 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -30.09 68.1 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.72 -35.2 67.5 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.429 -174.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 578' ' ' LEU . . . . . 0.508 HD12 HD23 ' A' ' 574' ' ' LEU . 13.9 mt . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 125.39 1.476 . . . . 0.0 112.891 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 11.8 pttt . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 122.702 1.239 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -103.2 169.6 8.46 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 128.478 2.711 . . . . 0.0 108.211 173.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' THR . . . . . 0.45 HG23 ' OG ' ' A' ' 538' ' ' SER . 44.8 m -45.77 -67.39 0.29 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.986 2.515 . . . . 0.0 111.586 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . 0.262 1.1 m 57.49 175.09 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 122.058 0.932 . . . . 0.0 109.81 -174.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.16 15.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 119.018 -2.301 . . . . 0.0 111.35 174.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 452' ' ' ARG . . . . . 0.477 ' HB3' ' CH2' ' A' ' 522' ' ' TRP . 16.4 mtt180 -86.27 -50.63 6.81 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 120.234 -1.541 . . . . 0.0 109.362 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 16.0 mm -63.15 -52.45 58.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.1 -42.43 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.486 1.039 . . . . 0.0 111.656 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 68.5 mt -72.96 -58.61 4.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 CA-C-N 118.719 0.691 . . . . 0.0 110.264 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.21 -32.65 60.36 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.344 0.973 . . . . 0.0 112.383 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 531' ' ' ALA . 64.9 mt -69.14 -49.55 55.93 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 117.527 0.663 . . . . 0.0 109.664 173.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.63 -38.43 75.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.67 0.788 . . . . 0.0 111.346 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.31 -55.43 24.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.069 1.348 . . . . 0.0 109.241 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' GLN . . . . . 0.587 ' HA ' HG23 ' A' ' 500' ' ' THR . 2.4 mp0 -70.06 -20.82 63.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 118.823 -0.608 . . . . 0.0 112.43 -178.28 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -141.58 80.07 16.5 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.712 1.605 . . . . 0.0 110.369 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.81 -15.34 40.51 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.467 1.445 . . . . 0.0 112.897 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -68.14 -18.94 64.76 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.824 1.193 . . . . 0.0 110.214 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 535' ' ' PHE . 79.6 mt -63.48 -13.37 39.99 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 121.33 -0.856 . . . . 0.0 110.827 173.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.03 -26.48 68.29 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 118.789 0.722 . . . . 0.0 111.115 173.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 90.6 m -82.92 -17.48 43.51 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.595 1.089 . . . . 0.0 110.854 174.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.73 -8.34 50.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.112 0.965 . . . . 0.0 111.375 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 489' ' ' VAL . 9.9 p -88.47 145.47 35.58 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-N 119.82 1.191 . . . . 0.0 108.488 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.01 170.98 13.17 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.566 2.844 . . . . 0.0 111.484 174.45 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.09 13.95 0.59 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.467 3.445 . . . . 0.0 113.933 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.627 ' HA ' HD13 ' A' ' 474' ' ' LEU . 9.6 mp 64.05 18.35 11.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.645 1.978 . . . . 0.0 115.935 173.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -47.1 -42.22 18.66 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.712 1.605 . . . . 0.0 114.78 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.26 6.59 48.63 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.908 0.883 . . . . 0.0 112.633 -175.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.797 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.2 mp -115.06 -71.83 0.72 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.662 1.585 . . . . 0.0 108.595 -173.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 16.5 t70 59.97 166.9 0.07 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 123.256 1.503 . . . . 0.0 110.118 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.3 -6.19 59.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 119.688 -1.882 . . . . 0.0 110.605 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -81.91 -44.85 16.26 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.72 1.608 . . . . 0.0 112.021 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -76.36 -21.2 56.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 119.072 -0.489 . . . . 0.0 111.662 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 52.9 mt -125.27 96.5 39.17 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-O 118.141 -0.933 . . . . 0.0 108.692 -178.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.46 78.11 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.792 2.995 . . . . 0.0 111.197 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.96 -17.06 2.37 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.875 2.179 . . . . 0.0 113.834 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 11.6 tp -56.24 -27.43 54.96 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.615 2.207 . . . . 0.0 110.231 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.05 -36.77 9.38 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 118.998 -0.89 . . . . 0.0 112.816 174.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -47.44 81.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.752 1.776 . . . . 0.0 110.276 175.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -59.74 -49.99 75.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.376 1.07 . . . . 0.0 110.658 174.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -61.77 -45.88 91.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.439 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -57.46 -52.84 63.77 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.782 HD11 HD21 ' A' ' 516' ' ' LEU . 0.0 OUTLIER -55.69 -48.66 74.73 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.851 0.46 . . . . 0.0 112.028 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 468' ' ' VAL . 75.3 t -58.79 -49.88 81.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -58.06 -46.37 85.52 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.928 1.291 . . . . 0.0 109.942 -175.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.7 m -62.81 -41.51 99.33 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 126.499 1.92 . . . . 0.0 110.785 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 44.3 m -62.14 -45.35 93.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.388 1.449 . . . . 0.0 110.38 176.15 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -23.91 67.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.983 0.913 . . . . 0.0 112.253 174.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -15.29 53.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.618 1.167 . . . . 0.0 111.535 176.815 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.9 75.82 66.16 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 124.984 1.314 . . . . 0.0 108.776 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.41 121.39 9.35 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.021 1.814 . . . . 0.0 109.474 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 98.47 8.24 54.97 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.375 0.988 . . . . 0.0 113.421 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.01 152.55 36.57 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.435 1.118 . . . . 0.0 108.027 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 7.3 p -134.03 169.53 17.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.151 0.98 . . . . 0.0 109.031 -174.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.587 HG23 ' HA ' ' A' ' 460' ' ' GLN . 5.1 m -49.88 -48.33 51.47 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.607 1.563 . . . . 0.0 111.509 174.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -82.94 -41.45 8.69 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -174.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 51.4 tp60 -63.6 -24.84 67.97 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.449 1.1 . . . . 0.0 111.296 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 68.4 tp -55.58 -50.3 70.45 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.676 1.19 . . . . 0.0 110.451 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.61 -35.06 79.77 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' GLU . . . . . 0.563 ' OE1' ' HD3' ' A' ' 508' ' ' ARG . 1.0 OUTLIER -70.98 -31.59 68.18 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 117.85 0.295 . . . . 0.0 110.217 178.541 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -70.12 -20.71 63.16 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -112.57 17.22 19.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.034 1.733 . . . . 0.0 109.751 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' ARG . . . . . 0.563 ' HD3' ' OE1' ' A' ' 505' ' ' GLU . 6.6 tpt180 -55.13 120.36 6.86 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.785 -1.197 . . . . 0.0 109.98 -174.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.43 18.25 78.13 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 118.641 -1.088 . . . . 0.0 113.542 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.827 HG22 ' H ' ' A' ' 512' ' ' ASN . 30.0 m -92.79 150.59 20.53 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.545 1.672 . . . . 0.0 107.998 -175.443 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -57.72 -20.83 37.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.897 0.856 . . . . 0.0 112.385 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.827 ' H ' HG22 ' A' ' 510' ' ' THR . 11.6 m-20 -93.39 -17.91 22.97 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.819 1.247 . . . . 0.0 109.703 -177.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -54.29 -38.44 65.91 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.208 1.403 . . . . 0.0 110.971 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.1 88.74 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.822 1.192 . . . . 0.0 111.868 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 32.1 m -65.63 -43.16 90.35 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.679 0.792 . . . . 0.0 109.712 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.782 HD21 HD11 ' A' ' 488' ' ' LEU . 13.1 mt -66.7 -32.78 74.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.276 0.631 . . . . 0.0 112.09 179.143 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.19 -44.52 96.42 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.84 1.656 . . . . 0.0 108.413 174.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.37 -37.38 83.16 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 123.714 0.805 . . . . 0.0 109.899 -177.414 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.35 -31.04 38.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.89 1.676 . . . . 0.0 114.277 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.4 t -70.33 -53.85 14.99 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 124.989 1.315 . . . . 0.0 110.53 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -71.24 9.73 0.71 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.782 1.633 . . . . 0.0 114.03 175.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.477 ' CH2' ' HB3' ' A' ' 452' ' ' ARG . 0.8 OUTLIER -78.33 85.61 4.45 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.925 1.29 . . . . 0.0 113.512 -173.451 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -2.63 1.25 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.632 1.973 . . . . 0.0 112.998 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.78 -0.93 10.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.514 1.526 . . . . 0.0 112.503 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -150.17 -63.14 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 127.463 2.305 . . . . 0.0 109.869 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.62 21.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.272 2.629 . . . . 0.0 116.97 173.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -116.75 177.36 4.73 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.5 1.12 . . . . 0.0 110.041 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -135.11 -30.11 1.07 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 126.775 2.03 . . . . 0.0 112.011 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -81.81 -56.28 4.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.319 1.447 . . . . 0.0 109.167 174.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.51 -28.23 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.799 1.24 . . . . 0.0 108.179 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.44 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -53.88 -50.63 65.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.002 0.819 . . . . 0.0 111.718 177.837 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.53 -49.95 67.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.829 0.74 . . . . 0.0 109.692 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -48.81 73.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.692 0.797 . . . . 0.0 110.916 177.134 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.1 m -66.23 -32.42 73.83 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 118.161 -0.923 . . . . 0.0 109.083 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.408 ' CD1' HD13 ' A' ' 464' ' ' LEU . 37.9 t80 -63.78 -54.1 40.5 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 120.519 1.509 . . . . 0.0 108.906 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 29.8 m -58.89 -45.97 88.97 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.385 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.57 -41.68 98.38 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.974 1.261 . . . . 0.0 112.165 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.45 ' OG ' HG23 ' A' ' 449' ' ' THR . 5.6 t -64.21 -49.84 70.42 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.68 1.992 . . . . 0.0 110.334 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 3.7 tt -55.51 -50.04 71.01 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 124.65 1.18 . . . . 0.0 108.002 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -55.69 -44.61 77.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.814 0.846 . . . . 0.0 108.812 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -61.84 -44.47 96.76 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.192 0.905 . . . . 0.0 110.538 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -51.26 70.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.326 -0.858 . . . . 0.0 108.736 178.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.797 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.8 m-85 -59.96 -49.33 78.09 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 123.823 0.849 . . . . 0.0 109.883 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -50.39 -52.11 40.31 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.481 2.312 . . . . 0.0 110.092 177.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -44.19 91.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.547 1.139 . . . . 0.0 112.132 176.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.37 -39.6 92.51 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 120.888 -1.133 . . . . 0.0 111.355 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 23.9 mt -67.49 -38.72 84.76 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.229 1.412 . . . . 0.0 108.891 176.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.25 -51.19 69.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.621 1.568 . . . . 0.0 109.44 174.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.94 -47.78 81.89 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.91 -45.13 93.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 117.742 -1.123 . . . . 0.0 109.73 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -52.89 56.14 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.393 1.077 . . . . 0.0 109.853 175.417 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -36.03 82.82 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.166 -177.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -62.03 -43.98 97.68 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 111.491 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.443 ' HB3' HD11 ' A' ' 571' ' ' LEU . 12.2 mt -63.06 -55.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.944 1.298 . . . . 0.0 108.485 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.06 -37.26 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.8 66.87 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 120.084 -1.635 . . . . 0.0 111.659 174.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -96.22 0.01 50.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 116.629 -1.653 . . . . 0.0 112.476 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.59 -44.72 11.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 121.406 1.912 . . . . 0.0 110.617 174.319 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 1.1 11.74 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.053 1.341 . . . . 0.0 113.471 -173.63 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 561' ' ' HIS . 5.1 t -139.73 -88.74 0.19 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -178.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.696 ' H ' HG23 ' A' ' 560' ' ' THR . 0.7 OUTLIER -50.67 -49.64 56.76 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.767 0.827 . . . . 0.0 111.831 -176.876 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.79 87.79 1.38 Allowed Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 107.341 -2.304 . . . . 0.0 107.341 -175.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 163.27 10.59 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 173.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 32.3 p -67.37 170.13 7.84 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.431 -0.793 . . . . 0.0 111.737 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -64.21 -38.08 89.79 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -64.02 -49.66 71.53 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 124.829 1.252 . . . . 0.0 108.624 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.09 -37.22 84.24 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.816 1.644 . . . . 0.0 110.637 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.648 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.2 OUTLIER -66.98 -30.1 70.13 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.311 1.445 . . . . 0.0 112.541 174.663 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 13.5 mt -78.86 -38.68 37.27 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-O 117.529 -1.224 . . . . 0.0 109.286 173.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -53.27 -42.35 66.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 119.508 1.049 . . . . 0.0 108.463 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 568' ' ' ARG . 10.4 mt -53.09 -44.77 67.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.714 1.206 . . . . 0.0 112.736 173.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -52.13 67.01 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 120.113 1.324 . . . . 0.0 109.182 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.41 -45.26 92.0 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.886 0.742 . . . . 0.0 109.861 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 4.3 tp -61.17 -39.16 89.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.998 1.319 . . . . 0.0 111.215 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -65.77 -36.39 83.42 Favored 'General case' 0 C--O 1.227 -0.097 0 C-N-CA 123.864 0.866 . . . . 0.0 109.659 177.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 11.7 tp60 -67.91 -38.46 82.97 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 110.664 176.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.27 -36.42 82.93 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.756 0.822 . . . . 0.0 110.273 176.537 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.0 mt -80.64 -22.72 40.26 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.902 0.881 . . . . 0.0 109.762 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -68.44 -17.94 64.32 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.019 0.528 . . . . 0.0 111.843 178.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -147.12 90.55 1.9 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 119.19 0.905 . . . . 0.0 109.346 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.482 0 C-N-CA 124.975 1.31 . . . . 0.0 113.28 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 123.777 1.751 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -104.54 136.57 43.85 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 104.02 -2.585 . . . . 0.0 104.02 -177.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 12.5 m -58.09 164.02 2.55 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 124.191 0.932 . . . . 0.0 110.897 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.3 p -77.61 -33.89 53.6 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 126.247 1.819 . . . . 0.0 112.374 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 69.91 -41.5 0.49 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 128.2 2.6 . . . . 0.0 112.138 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -64.93 -26.41 68.3 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-O 116.066 -1.921 . . . . 0.0 110.112 175.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.457 HD13 ' CH2' ' A' ' 522' ' ' TRP . 15.8 mm -66.6 -52.87 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 O-C-N 125.494 1.746 . . . . 0.0 108.33 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.508 HD23 ' CE1' ' A' ' 535' ' ' PHE . 12.5 mt -52.97 -45.25 67.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.662 1.119 . . . . 0.0 111.73 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.559 HD13 HD12 ' A' ' 484' ' ' LEU . 41.5 mt -71.55 -60.82 2.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-O 118.128 -0.939 . . . . 0.0 111.337 177.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -48.6 -43.51 28.67 Favored Glycine 0 C--O 1.227 -0.344 0 C-N-CA 126.088 1.804 . . . . 0.0 112.841 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.999 HD21 HG21 ' A' ' 525' ' ' ILE . 55.1 mt -66.25 -42.4 88.63 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 116.282 -1.818 . . . . 0.0 108.525 173.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.521 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.9 tm? -65.17 -28.62 69.52 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 120.89 1.677 . . . . 0.0 111.502 176.337 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 455' ' ' ILE . 31.4 t -66.66 -55.17 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -81.57 -11.52 59.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.015 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.793 ' HB3' HD12 ' A' ' 464' ' ' LEU . 5.0 t-20 -130.5 74.76 79.89 Favored Pre-proline 0 N--CA 1.447 -0.591 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 462' ' ' PRO . . . . . 0.723 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.6 Cg_endo -65.01 -18.79 63.05 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 120.979 1.119 . . . . 0.0 112.197 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.18 -19.71 62.37 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.261 -0.899 . . . . 0.0 111.211 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' A' ' 461' ' ' ASN . 17.2 mt -69.79 -13.58 62.35 Favored 'General case' 0 N--CA 1.461 0.075 0 CA-C-N 118.593 0.633 . . . . 0.0 111.169 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.58 -32.84 72.96 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 117.579 0.172 . . . . 0.0 110.965 174.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.3 m -79.04 -21.17 47.25 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.469 -0.769 . . . . 0.0 111.693 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 464' ' ' LEU . 0.5 OUTLIER -81.75 -19.26 41.73 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 121.513 -0.742 . . . . 0.0 110.297 174.891 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 489' ' ' VAL . 2.2 p -64.31 147.57 96.93 Favored Pre-proline 0 N--CA 1.444 -0.749 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -178.261 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.2 Cg_endo -74.5 172.77 15.49 Favored 'Trans proline' 0 N--CA 1.434 -1.985 0 C-N-CA 121.492 1.461 . . . . 0.0 109.829 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -75.42 4.4 4.98 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 124.172 3.248 . . . . 0.0 112.475 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.547 ' CD2' HD11 ' A' ' 482' ' ' LEU . 3.9 mp 66.21 68.58 0.44 Allowed 'General case' 0 C--N 1.348 0.537 0 C-N-CA 124.136 0.975 . . . . 0.0 109.132 177.494 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.98 -70.53 0.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.92 0.866 . . . . 0.0 110.215 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.64 31.17 5.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.732 0.813 . . . . 0.0 109.375 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.605 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.2 OUTLIER -90.26 -89.15 0.16 Allowed 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -177.364 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.7 t70 64.19 158.44 0.09 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.417 1.58 . . . . 0.0 110.324 -178.426 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.493 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 18.1 mt-10 -81.84 -16.26 51.36 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 120.4 -1.438 . . . . 0.0 109.094 173.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.76 -19.93 66.08 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 123.095 1.426 . . . . 0.0 112.801 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -101.27 -26.04 13.77 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 113.977 -1.465 . . . . 0.0 111.447 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 9.5 mt -142.52 116.11 6.38 Favored Pre-proline 0 N--CA 1.442 -0.832 0 O-C-N 124.127 0.892 . . . . 0.0 110.213 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.1 -44.2 13.15 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.269 1.979 . . . . 0.0 109.791 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -79.15 -20.91 68.81 Favored Glycine 0 C--N 1.339 0.697 0 O-C-N 120.396 -1.44 . . . . 0.0 112.117 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.547 HD11 ' CD2' ' A' ' 471' ' ' LEU . 1.9 tm? -55.14 -37.2 66.65 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 118.003 0.902 . . . . 0.0 110.203 174.675 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.493 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -51.17 -47.07 50.63 Favored Glycine 0 C--O 1.221 -0.709 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.33 175.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.676 HD13 HD12 ' A' ' 488' ' ' LEU . 1.2 tm? -52.06 -51.97 54.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.039 1.42 . . . . 0.0 111.639 176.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.48 ' CZ ' HD22 ' A' ' 454' ' ' LEU . 24.8 t80 -55.84 -51.9 65.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.812 0.845 . . . . 0.0 110.382 175.329 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.434 HH21 ' CG ' ' A' ' 490' ' ' ASN . 0.0 OUTLIER -59.88 -46.26 89.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.178 0.591 . . . . 0.0 111.372 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -63.2 -47.83 80.88 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 127.026 2.13 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.941 HD11 HD21 ' A' ' 516' ' ' LEU . 0.4 OUTLIER -57.06 -46.12 82.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.257 176.182 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 468' ' ' VAL . 72.1 t -63.48 -41.95 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 CA-C-O 117.069 -1.443 . . . . 0.0 108.708 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 490' ' ' ASN . . . . . 0.434 ' CG ' HH21 ' A' ' 486' ' ' ARG . 27.1 t-20 -54.43 -43.03 71.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 120.95 1.704 . . . . 0.0 110.779 -177.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 17.7 m -70.13 -48.35 57.84 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.803 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.538 ' SG ' HD22 ' A' ' 498' ' ' LEU . 72.7 m -59.46 -36.07 75.28 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 118.993 0.815 . . . . 0.0 111.662 177.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.663 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.3 OUTLIER -60.73 -15.19 26.69 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 128.115 2.566 . . . . 0.0 111.583 174.369 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.3 t -95.57 -57.74 2.3 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-O 116.59 -1.671 . . . . 0.0 108.087 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.448 ' CB ' HD13 ' A' ' 498' ' ' LEU . 27.7 mm100 -57.91 104.24 0.41 Allowed Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.662 1.585 . . . . 0.0 110.469 -175.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -79.24 122.68 5.28 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 123.01 2.474 . . . . 0.0 111.318 -174.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 67.3 33.15 81.59 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 118.623 -1.751 . . . . 0.0 112.71 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 462' ' ' PRO . 2.9 tp -64.42 148.49 50.39 Favored 'General case' 0 CA--C 1.506 -0.744 0 O-C-N 120.939 -1.33 . . . . 0.0 111.346 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 499' ' ' THR . . . . . 0.444 ' N ' ' HG ' ' A' ' 498' ' ' LEU . 1.1 p -112.05 169.16 9.04 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.96 1.704 . . . . 0.0 110.135 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.6 m -64.66 -35.51 81.26 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.12 -46.9 33.1 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 108.189 -1.964 . . . . 0.0 108.189 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -43.67 55.72 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.48 -173.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 28.5 tp -52.5 -54.89 26.5 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 118.63 0.65 . . . . 0.0 112.218 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.87 -34.84 65.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.941 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.11 -44.24 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 119.467 1.03 . . . . 0.0 112.23 175.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -68.54 -13.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.453 1.501 . . . . 0.0 111.146 176.495 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.657 ' CD2' HG21 ' A' ' 510' ' ' THR . 37.3 m-85 -118.36 18.56 13.63 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 125.425 1.49 . . . . 0.0 108.728 178.759 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -58.33 -20.49 43.72 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.795 1.634 . . . . 0.0 112.617 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -137.71 42.48 1.29 Allowed Glycine 0 N--CA 1.438 -1.172 0 C-N-CA 124.454 1.026 . . . . 0.0 111.141 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.781 HG22 ' H ' ' A' ' 512' ' ' ASN . 51.3 m -105.43 139.57 39.85 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.583 1.191 . . . . 0.0 109.041 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.03 -20.5 17.07 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 119.967 -1.708 . . . . 0.0 113.237 175.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.781 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m120 -94.53 -16.91 22.89 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 125.8 1.64 . . . . 0.0 112.173 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -43.88 -37.31 2.77 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 125.64 1.576 . . . . 0.0 110.589 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.79 -60.8 2.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.509 1.524 . . . . 0.0 110.392 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 51.5 m -61.93 -40.75 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.889 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' ' 488' ' ' LEU . 17.4 mt -60.7 -31.34 70.62 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 119.128 0.876 . . . . 0.0 111.171 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.06 -41.53 64.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 122.171 0.986 . . . . 0.0 110.987 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -34.72 78.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.179 174.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.43 HD13 HG22 ' A' ' 455' ' ' ILE . 92.1 mt -77.19 -8.86 58.27 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 116.525 -1.702 . . . . 0.0 112.195 174.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.5 t -76.16 -67.67 0.66 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.414 1.886 . . . . 0.0 109.264 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -2.07 8.36 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.536 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.4 t90 -49.37 136.67 15.64 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 123.02 0.528 . . . . 0.0 109.967 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.77 3.24 8.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 124.887 1.275 . . . . 0.0 108.457 -174.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -53.81 -37.78 63.9 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.515 1.15 . . . . 0.0 112.21 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.999 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -93.29 -55.71 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 113.308 -1.769 . . . . 0.0 109.027 179.421 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 45.95 40.07 6.38 Favored 'General case' 0 C--N 1.344 0.343 0 O-C-N 124.612 1.195 . . . . 0.0 110.838 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -159.47 153.21 22.92 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.94 -25.77 10.57 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.722 1.209 . . . . 0.0 111.388 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 21.1 t-20 -82.43 -62.83 1.51 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 124.042 0.937 . . . . 0.0 109.617 177.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 80.1 mt -52.39 -32.89 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.748 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -49.11 -58.42 4.99 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.006 175.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -50.34 -42.52 53.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.411 1.459 . . . . 0.0 113.14 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -51.68 63.15 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.795 176.159 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 534' ' ' THR . . . . . 0.43 HG22 HG21 ' A' ' 453' ' ' ILE . 17.0 m -61.72 -28.49 69.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.364 1.466 . . . . 0.0 110.031 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.624 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.0 t80 -69.08 -59.75 2.82 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 126.491 1.916 . . . . 0.0 109.816 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 35.3 m -61.18 -39.81 91.54 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 124.028 0.83 . . . . 0.0 109.259 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -56.86 -45.68 82.31 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.27 0.941 . . . . 0.0 110.195 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 3.6 t -65.18 -49.52 69.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.671 0.788 . . . . 0.0 111.461 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.461 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -55.4 -43.39 75.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.053 177.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.06 -41.21 96.18 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-O 116.166 -1.873 . . . . 0.0 107.46 176.192 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -68.73 -37.26 79.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 120.782 1.628 . . . . 0.0 109.569 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.8 ttp -62.58 -55.78 24.05 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.817 0.847 . . . . 0.0 110.413 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.697 ' HA ' HD12 ' A' ' 546' ' ' LEU . 6.3 m-85 -56.06 -45.52 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.367 1.867 . . . . 0.0 110.893 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -59.05 -48.96 79.7 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 126.214 1.806 . . . . 0.0 109.087 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' SER . . . . . 0.422 ' O ' ' HG ' ' A' ' 549' ' ' LEU . 3.1 t -56.28 -45.66 80.05 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.5 mt -63.16 -46.61 86.37 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.998 -1.064 . . . . 0.0 110.495 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 28.4 mt -60.62 -37.81 82.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.826 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.74 -52.63 35.25 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.632 1.573 . . . . 0.0 109.613 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 549' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 545' ' ' SER . 14.6 mt -56.28 -45.47 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.309 1.044 . . . . 0.0 108.702 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 35.7 ttt85 -55.15 -54.83 38.32 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.963 175.155 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.4 -55.31 9.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.207 1.567 . . . . 0.0 109.306 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.56 -38.52 81.34 Favored 'General case' 0 N--CA 1.442 -0.858 0 O-C-N 123.71 0.631 . . . . 0.0 109.982 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.74 -40.17 87.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 119.05 0.841 . . . . 0.0 112.818 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.754 ' HB2' HD21 ' A' ' 571' ' ' LEU . 2.4 mt -66.8 -51.1 59.64 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.55 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.475 HD13 HD13 ' A' ' 571' ' ' LEU . 38.4 mm -64.9 -38.68 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 CA-C-O 122.976 1.369 . . . . 0.0 110.843 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.42 65.93 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 119.843 -1.786 . . . . 0.0 109.949 174.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -106.26 11.65 30.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 125.51 1.524 . . . . 0.0 110.732 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 563' ' ' LEU . 0.9 OUTLIER -98.93 -29.8 12.73 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.994 1.27 . . . . 0.0 110.641 177.922 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -22.23 17.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.075 -178.049 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -96.55 -68.88 0.78 Allowed 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.222 1.487 . . . . 0.0 108.14 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -43.69 18.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.352 178.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 79.68 79.33 0.84 Allowed Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.552 HD11 ' HB2' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -44.9 157.65 0.07 Allowed 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 125.563 1.545 . . . . 0.0 110.743 172.503 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.16 157.95 7.61 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.597 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.446 ' O ' HD23 ' A' ' 569' ' ' LEU . 1.8 m-20 -53.07 -43.23 66.56 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.466 175.74 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.39 -46.74 88.9 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.158 177.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -60.59 -35.43 76.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.3 0.571 . . . . 0.0 111.478 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.507 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -65.02 -37.71 88.53 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.444 -0.785 . . . . 0.0 111.648 175.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.446 HD23 ' O ' ' A' ' 565' ' ' ASN . 4.2 mm? -66.55 -41.07 89.25 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-O 117.454 -1.26 . . . . 0.0 109.024 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -50.91 -38.3 49.18 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.807 0.813 . . . . 0.0 110.966 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 554' ' ' LEU . 2.0 mt -63.07 -46.59 86.76 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 118.002 -0.999 . . . . 0.0 112.21 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -50.68 52.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.711 1.141 . . . . 0.0 108.981 173.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -33.89 73.5 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -176.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -39.79 64.93 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.65 1.58 . . . . 0.0 111.036 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -56.97 -45.46 82.87 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.905 0.882 . . . . 0.0 108.869 174.561 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -66.3 -31.63 72.55 Favored 'General case' 0 C--O 1.189 -2.093 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 175.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . 0.265 0.3 OUTLIER -68.87 -23.08 64.17 Favored 'General case' 0 CA--C 1.497 -1.084 0 C-N-CA 129.72 3.208 . . . . 0.0 115.06 174.336 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.67 -25.88 12.53 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -87.41 55.97 3.75 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 117.861 -3.024 . . . . 0.0 110.809 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 62.75 167.12 0.12 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.718 1.207 . . . . 0.0 111.104 -177.536 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.06 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 118.639 -0.695 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 168.41 6.53 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 4.5 t -131.35 133.87 45.74 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 173.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 452' ' ' ARG . 10.2 t -66.52 152.1 45.92 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.285 -0.884 . . . . 0.0 108.973 174.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.9 11.92 0.13 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.645 1.578 . . . . 0.0 111.325 173.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 452' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 450' ' ' THR . 2.9 ttm180 -79.62 -30.47 41.43 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.515 -1.707 . . . . 0.0 109.836 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.561 HG21 ' HB2' ' A' ' 538' ' ' SER . 18.5 mm -61.98 -42.47 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 119.92 1.236 . . . . 0.0 109.458 175.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.485 ' CD2' ' HE3' ' A' ' 542' ' ' MET . 4.2 mm? -60.85 -52.75 63.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.644 -173.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.583 HG23 HD13 ' A' ' 488' ' ' LEU . 23.0 mt -65.5 -50.37 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 C-N-CA 124.665 1.186 . . . . 0.0 108.123 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -53.59 -50.32 53.94 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 126.074 1.797 . . . . 0.0 113.344 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.785 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -69.48 -47.41 64.01 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.291 -0.955 . . . . 0.0 109.046 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 465' ' ' ALA . 3.2 tm? -59.83 -33.22 71.47 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.431 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 2.4 t -60.27 -52.32 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 126.149 1.78 . . . . 0.0 108.434 175.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -76.34 -23.61 54.22 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 122.891 0.476 . . . . 0.0 111.97 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.449 ' HB3' HD12 ' A' ' 464' ' ' LEU . 6.0 t-20 -129.76 74.0 81.04 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 124.79 1.236 . . . . 0.0 110.097 -173.712 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -61.81 -19.5 65.75 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.282 1.988 . . . . 0.0 111.701 -174.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.87 -17.12 63.94 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.946 1.298 . . . . 0.0 111.607 173.604 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.566 HD22 ' CD2' ' A' ' 535' ' ' PHE . 19.1 mt -63.98 -13.43 46.25 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 120.113 -1.617 . . . . 0.0 109.965 173.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.557 ' HB1' HD23 ' A' ' 493' ' ' LEU . . . -65.23 -38.99 92.12 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 88.5 m -71.68 -18.26 62.19 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.001 1.273 . . . . 0.0 112.464 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.1 mt -87.93 -22.13 24.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.578 1.151 . . . . 0.0 112.29 173.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.696 ' CG1' HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -80.08 146.85 64.09 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.189 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.469 ' O ' HD12 ' A' ' 471' ' ' LEU . 23.9 Cg_endo -75.43 174.23 13.15 Favored 'Trans proline' 0 CA--C 1.553 1.426 0 C-N-CA 122.384 2.056 . . . . 0.0 111.494 174.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 470' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 469' ' ' PRO . 45.0 Cg_endo -69.34 4.37 2.05 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 125.115 3.877 . . . . 0.0 114.113 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 482' ' ' LEU . 5.5 mp 71.76 55.62 0.19 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.647 2.379 . . . . 0.0 112.442 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.86 -25.98 44.01 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 -178.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.29 2.08 10.27 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.714 1.206 . . . . 0.0 112.212 -176.589 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.454 HD21 ' CE1' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -88.38 -75.99 0.41 Allowed 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 126.008 1.723 . . . . 0.0 106.933 -173.486 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 9.9 t70 63.73 159.03 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 O-C-N 125.452 1.72 . . . . 0.0 112.542 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -93.77 -16.02 24.59 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 119.981 -1.7 . . . . 0.0 110.444 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.69 -22.38 43.49 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.286 2.235 . . . . 0.0 112.383 175.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -16.78 33.22 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 119.081 0.855 . . . . 0.0 111.664 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.44 103.92 6.53 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 123.397 0.679 . . . . 0.0 110.855 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.77 77.84 0.73 Allowed 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.603 3.536 . . . . 0.0 110.004 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.03 -11.08 3.09 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.866 1.698 . . . . 0.0 113.409 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.672 HD11 HD23 ' A' ' 471' ' ' LEU . 2.0 tm? -65.09 -34.31 78.11 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.434 1.617 . . . . 0.0 109.437 173.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.31 -38.47 12.71 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 119.254 0.933 . . . . 0.0 112.875 175.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 488' ' ' LEU . 0.5 OUTLIER -57.29 -55.05 39.74 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 117.791 0.796 . . . . 0.0 109.581 174.275 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -55.99 -47.43 77.72 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.728 0.811 . . . . 0.0 111.29 177.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -49.38 73.74 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.66 -38.76 80.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.738 1.215 . . . . 0.0 111.407 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.6 -49.72 76.68 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 125.688 1.595 . . . . 0.0 110.436 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.696 HG11 ' CG1' ' A' ' 468' ' ' VAL . 69.2 t -60.47 -49.94 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 CA-C-O 117.324 -1.322 . . . . 0.0 107.467 173.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -51.93 -45.48 64.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.121 1.328 . . . . 0.0 109.784 -175.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.9 m -64.1 -49.46 72.16 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 125.095 1.358 . . . . 0.0 110.45 173.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' A' ' 458' ' ' LEU . 98.9 m -58.18 -36.95 73.82 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.478 1.49 . . . . 0.0 113.216 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.557 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.5 OUTLIER -61.11 -21.68 63.93 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 130.044 3.338 . . . . 0.0 112.156 173.876 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.9 t -93.41 -61.72 1.51 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 174.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.422 ' HB3' HD13 ' A' ' 498' ' ' LEU . 63.8 mm-40 -48.91 91.88 0.04 OUTLIER Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 128.85 2.86 . . . . 0.0 112.206 -173.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -70.66 123.85 10.18 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.336 2.024 . . . . 0.0 111.345 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.07 37.72 94.92 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.441 HD21 HD13 ' A' ' 503' ' ' LEU . 22.6 tp -59.37 162.28 4.89 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.786 0.803 . . . . 0.0 110.187 175.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.75 164.32 29.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.024 1.33 . . . . 0.0 107.555 -176.497 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.7 m -52.37 -46.16 66.08 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.934 1.294 . . . . 0.0 110.268 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.24 -44.16 23.49 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.83 -26.9 68.98 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.011 0.925 . . . . 0.0 111.142 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.441 HD13 HD21 ' A' ' 498' ' ' LEU . 42.2 tp -60.6 -54.33 46.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.14 -32.72 73.35 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.711 0.805 . . . . 0.0 111.159 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.07 -44.31 80.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.574 1.15 . . . . 0.0 111.243 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -63.93 -18.27 64.06 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.245 1.818 . . . . 0.0 112.638 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.5 ' CD2' HD13 ' A' ' 516' ' ' LEU . 55.3 m-85 -113.13 18.57 17.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 127.29 2.236 . . . . 0.0 111.11 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.8 125.07 20.75 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.482 -1.386 . . . . 0.0 109.874 -176.38 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.65 37.55 61.69 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.769 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.4 m -108.44 151.48 26.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.058 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -61.29 -24.88 66.73 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.846 1.259 . . . . 0.0 110.678 173.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.769 ' H ' HG22 ' A' ' 510' ' ' THR . 10.2 m-80 -91.97 -16.91 25.89 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-O 116.979 -1.486 . . . . 0.0 109.909 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.98 -45.79 51.9 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-N 119.567 1.076 . . . . 0.0 108.661 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.47 -46.13 84.04 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 81.4 m -64.16 -47.59 79.27 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 118.504 -0.76 . . . . 0.0 109.244 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 488' ' ' LEU . 82.1 mt -58.39 -41.16 84.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.698 1.599 . . . . 0.0 110.79 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -41.79 74.43 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 127.155 2.182 . . . . 0.0 109.301 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -62.0 -41.11 97.7 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.373 -1.299 . . . . 0.0 108.533 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.402 HD13 HG22 ' A' ' 455' ' ' ILE . 92.8 mt -73.3 -16.55 61.37 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 175.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.7 t -70.4 -36.59 74.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.137 1.375 . . . . 0.0 109.6 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.39 2.74 31.56 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.108 1.763 . . . . 0.0 113.406 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.42 ' CE3' HD11 ' A' ' 525' ' ' ILE . 14.3 t90 -75.7 73.56 2.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.75 1.22 . . . . 0.0 108.693 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.45 -13.12 47.1 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.243 2.617 . . . . 0.0 111.182 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -52.61 -20.06 2.77 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.254 2.622 . . . . 0.0 113.205 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.785 HD13 ' CD2' ' A' ' 457' ' ' LEU . 54.0 mt -51.81 -69.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 128.813 2.845 . . . . 0.0 111.459 175.26 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -162.7 -94.79 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.77 1.294 . . . . 0.0 110.537 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -152.84 164.56 37.62 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.5 2.72 . . . . 0.0 108.22 -176.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -21.35 64.78 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 120.097 1.317 . . . . 0.0 113.829 174.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.22 -57.42 3.27 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.937 1.695 . . . . 0.0 108.769 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 16.3 mt -71.17 -2.07 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.504 1.522 . . . . 0.0 110.199 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.498 ' HB1' ' CD1' ' A' ' 457' ' ' LEU . . . -56.56 -64.08 0.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.666 1.121 . . . . 0.0 108.258 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 532' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 464' ' ' LEU . 30.7 tt0 -55.47 -35.81 65.91 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.827 0.451 . . . . 0.0 111.285 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -51.19 59.36 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 117.346 -1.311 . . . . 0.0 110.473 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 52.6 m -57.96 -36.7 72.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.615 1.966 . . . . 0.0 110.079 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.566 ' CD2' HD22 ' A' ' 464' ' ' LEU . 73.3 t80 -62.22 -56.01 22.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.464 -0.779 . . . . 0.0 110.75 175.374 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 52.3 m -62.34 -42.52 99.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.089 -0.958 . . . . 0.0 108.944 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.42 -47.26 82.22 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.87 1.268 . . . . 0.0 110.201 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.561 ' HB2' HG21 ' A' ' 453' ' ' ILE . 8.7 t -66.68 -44.53 81.53 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.164 0.986 . . . . 0.0 110.919 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.402 ' CD1' HG23 ' A' ' 468' ' ' VAL . 1.0 OUTLIER -55.46 -51.09 68.07 Favored 'General case' 0 C--O 1.202 -1.421 0 C-N-CA 125.157 1.383 . . . . 0.0 108.935 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -60.14 -43.94 95.33 Favored 'General case' 0 C--N 1.372 1.564 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -66.36 -38.52 87.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 120.046 -1.659 . . . . 0.0 111.59 -178.027 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' MET . . . . . 0.485 ' HE3' ' CD2' ' A' ' 454' ' ' LEU . 0.5 OUTLIER -64.97 -54.91 23.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.454 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.0 m-85 -60.43 -47.39 86.31 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.025 1.33 . . . . 0.0 108.1 -175.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -52.23 -51.93 55.4 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.227 2.211 . . . . 0.0 110.377 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.1 t -51.48 -50.57 59.6 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.482 0.713 . . . . 0.0 111.342 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 474' ' ' LEU . 55.8 mt -66.19 -40.96 90.8 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.722 1.209 . . . . 0.0 111.374 -174.498 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.06 -38.7 92.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.651 1.981 . . . . 0.0 109.201 174.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -49.96 54.65 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.488 1.515 . . . . 0.0 109.766 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 13.6 mt -58.23 -45.96 86.77 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.291 1.436 . . . . 0.0 109.586 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -59.96 -46.76 88.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.068 0.947 . . . . 0.0 109.648 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -53.84 -47.73 70.65 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.67 -50.07 73.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.396 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -43.63 81.41 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.423 1.889 . . . . 0.0 110.605 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.564 ' HB2' HD21 ' A' ' 571' ' ' LEU . 11.1 mt -59.25 -52.64 64.8 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.696 1.199 . . . . 0.0 109.365 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 33.4 mm -63.62 -34.94 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 121.379 1.899 . . . . 0.0 113.1 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -57.64 -37.5 73.45 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -67.96 2.24 2.18 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 128.593 2.757 . . . . 0.0 112.999 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -94.22 -54.4 3.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 119.809 1.186 . . . . 0.0 111.606 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -72.07 8.57 1.22 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.855 1.262 . . . . 0.0 113.451 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.5 p -124.44 -67.4 0.92 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.11 0.964 . . . . 0.0 110.599 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.59 -68.06 0.82 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.695 1.998 . . . . 0.0 109.181 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 140.02 132.07 2.84 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 126.409 1.957 . . . . 0.0 108.544 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.7 120.47 22.68 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.86 172.93 0.48 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.087 0.946 . . . . 0.0 109.712 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.57 -45.99 90.22 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 121.322 -0.861 . . . . 0.0 109.952 172.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.29 -46.15 67.88 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-O 116.998 -1.477 . . . . 0.0 110.319 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -62.63 -42.71 99.75 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 121.116 1.78 . . . . 0.0 110.262 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -59.48 -37.58 78.59 Favored 'General case' 0 C--N 1.343 0.306 0 O-C-N 120.897 -1.127 . . . . 0.0 110.9 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 39.4 mt -73.48 -39.92 64.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.512 176.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -46.54 56.91 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.649 1.58 . . . . 0.0 107.832 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 554' ' ' LEU . 3.1 mt -55.99 -45.89 78.86 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 174.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -47.73 77.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.661 1.119 . . . . 0.0 108.144 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -32.73 73.33 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 118.943 -0.551 . . . . 0.0 111.093 -178.103 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.74 -37.91 82.81 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.701 1.137 . . . . 0.0 110.347 174.035 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -71.58 -31.3 66.8 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 120.409 -1.432 . . . . 0.0 109.801 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -73.31 -25.41 60.64 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.608 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -78.04 -35.0 50.24 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.854 1.661 . . . . 0.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.69 -20.28 46.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.801 1.64 . . . . 0.0 111.911 176.08 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -157.4 -88.12 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.786 -1.197 . . . . 0.0 109.776 175.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -172.7 148.43 1.9 Allowed 'General case' 0 C--O 1.235 0.307 0 C-N-CA 125.069 1.347 . . . . 0.0 109.012 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.4 tttp . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.53 69.79 0.5 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 126.385 1.874 . . . . 0.0 109.89 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 3.8 m -140.64 130.02 23.84 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 119.41 -2.056 . . . . 0.0 107.251 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.0 t -150.07 28.92 0.74 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.278 0.631 . . . . 0.0 110.499 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 1.5 mtt 75.68 -38.83 0.37 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 127.163 2.185 . . . . 0.0 110.604 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' ARG . . . . . 0.544 ' HD2' HD21 ' A' ' 519' ' ' LEU . 12.6 mmt85 -59.98 -30.41 69.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.021 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 534' ' ' THR . 1.5 mm -63.7 -52.98 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 120.067 1.303 . . . . 0.0 108.162 174.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.87 -52.9 63.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.571 1.078 . . . . 0.0 108.389 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 38.7 mt -66.63 -53.5 34.71 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.082 -176.432 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -55.6 -41.37 81.67 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 128.19 2.805 . . . . 0.0 112.234 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.3 mt -70.92 -36.03 72.51 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 118.073 -0.965 . . . . 0.0 109.399 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -27.97 67.13 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.259 1.391 . . . . 0.0 111.744 173.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.448 ' HA ' HD23 ' A' ' 503' ' ' LEU . 33.6 t -69.24 -56.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 125.089 1.356 . . . . 0.0 107.908 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -75.9 -8.51 57.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.488 ' HB3' HD12 ' A' ' 464' ' ' LEU . 20.4 t-20 -146.96 70.65 12.21 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 121.198 -0.939 . . . . 0.0 111.706 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.52 -17.85 60.32 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.832 1.688 . . . . 0.0 111.446 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.91 -22.87 64.14 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 120.343 -1.473 . . . . 0.0 112.352 173.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.63 HD13 ' CD1' ' A' ' 535' ' ' PHE . 49.3 mt -59.84 -14.99 17.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.531 1.06 . . . . 0.0 109.907 173.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.26 -20.57 66.48 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.743 -0.598 . . . . 0.0 112.299 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 77.4 m -83.96 -26.19 29.44 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 119.387 0.994 . . . . 0.0 110.254 173.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.551 HD12 HD23 ' A' ' 464' ' ' LEU . 28.6 mt -84.98 -14.98 45.81 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.355 -0.84 . . . . 0.0 112.275 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 489' ' ' VAL . 3.0 p -69.41 152.09 96.56 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.18 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.467 ' CD ' HD11 ' A' ' 539' ' ' LEU . 18.1 Cg_endo -73.74 170.63 19.57 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.063 1.842 . . . . 0.0 111.488 173.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -74.51 2.28 6.51 Favored 'Trans proline' 0 CA--C 1.541 0.838 1 C-N-CA 125.533 4.155 . . . . 0.0 113.953 173.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.571 HD23 HH11 ' A' ' 486' ' ' ARG . 1.0 OUTLIER 71.09 65.82 0.17 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.92 2.488 . . . . 0.0 110.854 174.441 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -73.23 -72.98 0.23 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.51 1.124 . . . . 0.0 110.206 -173.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.88 13.72 13.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.665 1.186 . . . . 0.0 112.397 176.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.511 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.3 OUTLIER -87.14 -85.52 0.17 Allowed 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 -173.498 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.0 t0 62.47 152.13 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 O-C-N 126.384 2.302 . . . . 0.0 111.944 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -84.31 -18.46 36.24 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 118.678 -2.514 . . . . 0.0 108.896 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -78.3 -9.03 59.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.885 1.674 . . . . 0.0 112.95 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -116.74 5.98 13.2 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.569 1.547 . . . . 0.0 111.186 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.666 HD13 ' HG ' ' A' ' 482' ' ' LEU . 0.4 OUTLIER -129.29 163.02 49.02 Favored Pre-proline 0 C--O 1.221 -0.433 0 C-N-CA 126.226 1.81 . . . . 0.0 110.193 -179.051 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -80.89 -67.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 120.867 1.045 . . . . 0.0 112.991 -172.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -128.03 25.06 4.99 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.666 ' HG ' HD13 ' A' ' 479' ' ' LEU . 1.7 tm? -62.47 -31.22 71.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.051 -0.976 . . . . 0.0 108.565 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.09 -38.28 6.09 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-O 118.644 -1.087 . . . . 0.0 111.696 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -55.55 33.33 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.09 1.945 . . . . 0.0 111.728 174.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.53 ' HB3' HD22 ' A' ' 482' ' ' LEU . 81.9 t80 -53.69 -54.78 33.05 Favored 'General case' 0 C--N 1.337 0.029 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.721 174.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.571 HH11 HD23 ' A' ' 471' ' ' LEU . 2.2 ttp85 -55.61 -46.18 77.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.535 0.734 . . . . 0.0 110.973 -173.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.59 -39.01 70.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.837 1.255 . . . . 0.0 110.719 -175.53 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.784 HD11 HD21 ' A' ' 516' ' ' LEU . 2.5 mt -61.16 -46.28 91.16 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 123.282 0.633 . . . . 0.0 109.862 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 468' ' ' VAL . 67.4 t -61.92 -47.85 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-O 118.095 -0.955 . . . . 0.0 108.606 176.251 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -54.38 -47.23 72.91 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.616 1.566 . . . . 0.0 109.982 -177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 89.5 m -63.96 -47.49 80.2 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 126.07 1.748 . . . . 0.0 109.894 172.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.2 m -60.74 -36.93 80.13 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.213 -2.18 . . . . 0.0 111.923 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.46 -26.82 68.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.939 2.096 . . . . 0.0 111.55 173.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.78 -53.67 7.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.579 1.552 . . . . 0.0 108.345 173.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -64.06 101.06 0.24 Allowed Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 119.645 1.111 . . . . 0.0 111.883 -175.044 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -63.25 128.73 23.44 Favored 'Trans proline' 0 N--CA 1.439 -1.717 0 N-CA-C 107.329 -1.835 . . . . 0.0 107.329 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.63 48.05 56.7 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 124.374 0.988 . . . . 0.0 113.093 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.601 HD21 HD13 ' A' ' 503' ' ' LEU . 32.6 tp -63.61 155.54 29.39 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.149 0.979 . . . . 0.0 110.272 173.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.0 163.65 29.8 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.568 1.947 . . . . 0.0 108.19 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 86.0 m -51.34 -46.69 62.75 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.182 0.993 . . . . 0.0 110.551 173.733 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.41 -43.89 14.59 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -62.0 -24.2 66.9 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.778 0.831 . . . . 0.0 111.188 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.601 HD13 HD21 ' A' ' 498' ' ' LEU . 24.1 tp -67.09 -51.22 57.04 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 123.876 0.87 . . . . 0.0 110.778 176.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.8 mt -61.18 -34.41 75.01 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 122.76 0.424 . . . . 0.0 110.151 173.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.98 -39.29 90.22 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.466 -0.771 . . . . 0.0 112.318 177.523 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 47.3 t-80 -65.6 -17.84 64.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.615 1.566 . . . . 0.0 112.577 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -117.26 21.37 13.18 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.99 2.116 . . . . 0.0 110.776 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.18 131.2 50.07 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 119.952 -1.718 . . . . 0.0 109.194 -175.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 67.86 31.08 74.93 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 173.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.796 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.9 m -102.31 148.69 25.15 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.74 -21.66 64.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.797 1.239 . . . . 0.0 111.362 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 t-20 -92.6 -15.75 26.49 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.463 1.505 . . . . 0.0 111.58 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.78 -47.57 59.62 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.77 61.59 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.232 1.013 . . . . 0.0 113.28 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 30.0 m -66.48 -48.74 68.89 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.116 0.966 . . . . 0.0 110.382 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.784 HD21 HD11 ' A' ' 488' ' ' LEU . 65.2 mt -57.06 -39.43 74.9 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.351 1.46 . . . . 0.0 111.961 174.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -75.02 -34.3 61.9 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 127.296 2.238 . . . . 0.0 110.923 -177.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -33.98 75.85 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 173.447 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.544 HD21 ' HD2' ' A' ' 452' ' ' ARG . 77.2 mt -78.83 -13.87 59.56 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.953 1.251 . . . . 0.0 114.353 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.5 t -72.86 -60.46 2.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.144 1.378 . . . . 0.0 108.739 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -71.1 0.76 6.92 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.646 1.578 . . . . 0.0 113.973 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.96 111.13 3.18 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 124.257 1.023 . . . . 0.0 111.903 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.53 0.25 47.14 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.59 2.356 . . . . 0.0 110.095 -175.543 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.25 -18.88 60.57 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 125.983 1.713 . . . . 0.0 111.759 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -122.19 -78.58 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 131.26 3.824 . . . . 0.0 109.743 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.3 59.95 4.11 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.151 1.78 . . . . 0.0 111.914 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -153.7 170.78 20.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.853 0.861 . . . . 0.0 110.914 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.22 -32.07 4.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 127.55 2.34 . . . . 0.0 110.911 173.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -84.84 -55.82 3.89 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 120.552 -1.343 . . . . 0.0 109.115 -177.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 63.7 mt -58.05 -27.64 32.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 124.235 1.014 . . . . 0.0 108.56 174.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.91 -59.93 3.62 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 125.168 1.387 . . . . 0.0 109.978 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.28 -42.95 64.16 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.386 0.994 . . . . 0.0 109.75 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -48.65 66.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 534' ' ' THR . . . . . 0.546 ' CG2' HD12 ' A' ' 453' ' ' ILE . 89.3 m -61.96 -32.75 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.79 2.036 . . . . 0.0 108.298 177.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.63 ' CD1' HD13 ' A' ' 464' ' ' LEU . 53.9 t80 -64.68 -58.71 5.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 125.496 1.519 . . . . 0.0 109.839 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -60.0 -43.82 94.95 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.303 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.45 -43.41 68.05 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 120.878 1.672 . . . . 0.0 109.473 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.404 ' HB2' ' CG2' ' A' ' 453' ' ' ILE . 2.6 t -71.07 -48.23 53.82 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.467 HD11 ' CD ' ' A' ' 469' ' ' PRO . 0.7 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 176.428 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -43.91 96.78 Favored 'General case' 0 C--N 1.355 0.833 0 CA-C-O 117.776 -1.107 . . . . 0.0 108.967 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -67.38 -38.44 84.73 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.458 -1.401 . . . . 0.0 111.285 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -54.57 38.25 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.654 ' HA ' HD12 ' A' ' 546' ' ' LEU . 8.5 m-85 -56.39 -48.23 77.31 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.49 1.916 . . . . 0.0 109.783 178.167 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.19 -50.48 71.09 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 127.15 2.18 . . . . 0.0 110.134 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.0 t -50.84 -41.28 57.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.002 0.921 . . . . 0.0 111.253 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.654 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.8 mt -72.85 -41.66 64.55 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 120.504 -1.372 . . . . 0.0 110.596 -176.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 547' ' ' LEU . 21.9 mt -59.56 -45.07 92.89 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 173.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -63.04 -50.78 69.29 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.008 2.123 . . . . 0.0 110.164 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.71 -44.03 77.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.192 1.797 . . . . 0.0 110.08 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -57.35 -46.89 82.86 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.777 -0.63 . . . . 0.0 109.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -55.36 -47.18 76.15 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.661 1.184 . . . . 0.0 110.457 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.44 -39.4 88.87 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -178.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -39.81 93.41 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 124.987 1.315 . . . . 0.0 111.256 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.461 ' HB2' HD21 ' A' ' 571' ' ' LEU . 3.6 mt -60.56 -55.2 36.19 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 571' ' ' LEU . 23.1 mm -60.68 -41.26 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 121.068 1.758 . . . . 0.0 111.199 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -62.74 -15.59 53.9 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 119.985 -1.697 . . . . 0.0 113.134 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -98.43 13.79 30.42 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 129.263 3.025 . . . . 0.0 111.028 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -104.25 -61.78 1.4 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 120.502 1.501 . . . . 0.0 109.736 173.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -63.91 -7.75 9.15 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 79.2 p -113.01 -64.4 1.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.065 2.546 . . . . 0.0 109.05 -173.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -93.42 -64.51 1.08 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.102 2.161 . . . . 0.0 111.023 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 134.52 119.95 2.01 Favored Glycine 0 CA--C 1.529 0.961 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 563' ' ' LEU . 7.1 mt -78.22 131.16 37.03 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.11 171.28 5.79 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.35 -43.89 96.4 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.794 -0.622 . . . . 0.0 110.594 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.49 -54.32 29.97 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 567' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 571' ' ' LEU . 13.6 mm-40 -60.18 -30.53 69.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 O-C-N 119.534 -1.978 . . . . 0.0 115.658 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -68.44 -32.97 73.37 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.641 1.176 . . . . 0.0 109.971 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.42 -38.17 50.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 117.824 -1.084 . . . . 0.0 108.72 174.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.91 -44.22 50.1 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 119.857 1.208 . . . . 0.0 108.256 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 555' ' ' ILE . 1.1 mp -57.79 -44.55 86.37 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.47 175.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -46.8 79.7 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.421 1.464 . . . . 0.0 108.542 177.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -30.33 70.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -39.86 70.87 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.494 1.518 . . . . 0.0 110.016 173.437 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -65.11 -38.91 92.23 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.636 1.574 . . . . 0.0 110.887 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -34.35 77.68 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.11 174.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -32.49 63.62 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 128.228 2.611 . . . . 0.0 111.497 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER -90.63 -24.19 20.59 Favored 'General case' 0 C--O 1.259 1.572 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 49.95 63.59 2.12 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 127.982 2.513 . . . . 0.0 111.905 175.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 3.7 mmtm 71.72 -174.61 0.17 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.869 2.068 . . . . 0.0 107.015 -173.114 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.8 tttm . . . . . 0 C--O 1.283 2.825 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -176.411 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.46 176.7 0.28 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 127.539 2.335 . . . . 0.0 109.342 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 60.0 m -113.51 -77.71 0.58 Allowed 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 13.6 t 41.45 44.79 2.57 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.269 1.828 . . . . 0.0 112.789 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 ptt? 52.62 3.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.629 2.772 . . . . 0.0 115.551 -173.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 65.6 mtt-85 -81.69 -48.06 12.17 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 116.363 -1.779 . . . . 0.0 110.881 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.52 HG23 ' CD1' ' A' ' 457' ' ' LEU . 0.5 OUTLIER -57.64 -49.77 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.081 1.309 . . . . 0.0 109.514 -177.182 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.61 -41.97 64.16 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.661 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 96.7 mt -73.52 -53.49 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 119.498 1.044 . . . . 0.0 112.195 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.95 -29.08 72.53 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 119.74 1.155 . . . . 0.0 113.737 -173.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 525' ' ' ILE . 40.5 mt -70.91 -43.12 68.95 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.571 1.186 . . . . 0.0 108.73 174.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.57 -35.19 77.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.488 1.515 . . . . 0.0 110.765 174.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.28 -47.05 95.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.29 -0.881 . . . . 0.0 110.245 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -83.09 -14.38 53.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.522 0.729 . . . . 0.0 110.822 -174.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.425 ' HB3' HD12 ' A' ' 464' ' ' LEU . 55.6 t-20 -145.09 78.6 12.33 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.511 1.924 . . . . 0.0 111.403 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.72 -20.01 64.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 121.019 1.146 . . . . 0.0 113.331 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.56 -15.95 59.45 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.137 1.335 . . . . 0.0 111.109 174.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.425 HD12 ' HB3' ' A' ' 461' ' ' ASN . 45.3 mt -63.4 -15.76 58.52 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 121.022 -1.048 . . . . 0.0 109.942 173.255 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -63.72 -25.22 68.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.932 0.787 . . . . 0.0 110.831 173.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 63.4 m -83.54 -17.4 41.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 0.999 . . . . 0.0 111.881 174.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.4 mt -94.34 -5.59 46.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 111.98 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 489' ' ' VAL . 7.1 p -82.95 144.81 48.39 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 120.662 1.574 . . . . 0.0 108.691 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.66 164.38 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.586 2.857 . . . . 0.0 111.461 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -67.57 12.87 0.18 Allowed 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 124.232 3.288 . . . . 0.0 114.445 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.319 1.7 mp 80.67 8.34 1.27 Allowed 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 129.207 3.003 . . . . 0.0 115.664 173.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -33.33 -55.2 0.42 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.188 2.995 . . . . 0.0 115.01 -174.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.09 -5.53 21.99 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.757 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.446 HD21 ' CE1' ' A' ' 543' ' ' PHE . 45.6 mt -71.21 -86.29 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.561 1.544 . . . . 0.0 110.887 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . 0.276 24.2 t0 58.96 140.97 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.946 3.298 . . . . 0.0 111.696 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -65.64 -29.91 70.55 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.234 1.814 . . . . 0.0 110.285 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -63.59 -24.2 67.7 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.764 1.165 . . . . 0.0 112.431 174.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -92.43 -17.23 24.86 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 120.934 1.697 . . . . 0.0 112.077 176.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.47 ' HG ' HD21 ' A' ' 546' ' ' LEU . 7.1 mt -128.32 86.32 58.18 Favored Pre-proline 0 CA--C 1.515 -0.378 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.76 90.15 0.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.057 1.838 . . . . 0.0 110.058 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 134.17 -16.18 4.44 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.537 2.018 . . . . 0.0 113.156 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 479' ' ' LEU . 4.6 tp -58.19 -24.43 59.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.326 2.063 . . . . 0.0 110.277 173.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.6 -41.49 12.84 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 118.689 0.677 . . . . 0.0 111.875 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -40.79 94.09 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.148 1.474 . . . . 0.0 111.363 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -65.07 -53.03 52.01 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.89 1.276 . . . . 0.0 109.776 173.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -41.56 99.49 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.524 0.73 . . . . 0.0 111.127 -173.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.79 -44.0 82.43 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.815 0.846 . . . . 0.0 109.542 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.602 HD11 HD21 ' A' ' 516' ' ' LEU . 3.4 mt -54.8 -51.46 65.73 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.966 0.506 . . . . 0.0 111.023 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 468' ' ' VAL . 55.4 t -56.81 -47.65 82.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 125.097 1.359 . . . . 0.0 109.924 175.797 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -55.46 -45.08 76.92 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.473 1.509 . . . . 0.0 110.079 179.244 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.3 m -65.41 -40.19 93.07 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.791 1.636 . . . . 0.0 111.263 174.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.8 m -64.85 -44.27 90.3 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 120.022 1.283 . . . . 0.0 110.397 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.24 -20.67 59.88 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.097 1.359 . . . . 0.0 112.815 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 16.8 t -93.43 -37.42 11.97 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.381 1.872 . . . . 0.0 111.367 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -76.76 105.79 2.75 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.95 1.3 . . . . 0.0 110.065 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.64 115.05 4.2 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.792 1.661 . . . . 0.0 110.94 -173.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.54 36.92 47.75 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.38 155.47 11.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.006 0.922 . . . . 0.0 110.542 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 10.8 p -139.87 174.09 10.87 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.2 m -55.95 -50.04 71.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.644 0.777 . . . . 0.0 109.859 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.08 -43.57 47.95 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -174.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -66.34 -24.52 66.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.347 1.059 . . . . 0.0 110.585 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.47 -52.47 61.24 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 119.609 1.095 . . . . 0.0 109.035 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.83 -38.77 89.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 118.551 -0.738 . . . . 0.0 109.919 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.66 -40.98 98.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.404 0.682 . . . . 0.0 110.709 177.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.59 -20.49 63.64 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.152 -0.968 . . . . 0.0 112.713 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -106.61 14.36 27.09 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.392 1.077 . . . . 0.0 109.004 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -58.59 119.93 7.94 Favored 'General case' 0 CA--C 1.528 0.118 0 O-C-N 119.801 -1.812 . . . . 0.0 111.41 -174.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.9 15.98 66.35 Favored Glycine 0 CA--C 1.527 0.783 0 CA-C-O 119.176 -0.791 . . . . 0.0 113.012 177.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.842 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.3 m -98.17 153.07 18.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -173.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -60.19 -20.35 58.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.225 -0.922 . . . . 0.0 112.039 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.842 ' H ' HG22 ' A' ' 510' ' ' THR . 76.5 m-20 -89.83 -19.31 24.81 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.128 1.771 . . . . 0.0 110.519 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.61 -51.13 58.09 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 124.473 1.109 . . . . 0.0 110.213 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.92 -44.18 60.08 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.942 0.897 . . . . 0.0 112.321 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 53.0 m -62.24 -50.41 71.84 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.884 174.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.602 HD21 HD11 ' A' ' 488' ' ' LEU . 21.9 mt -60.09 -39.15 85.12 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.555 1.07 . . . . 0.0 111.534 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.94 -45.79 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.807 2.043 . . . . 0.0 109.381 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -61.42 -29.86 70.2 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.335 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 73.8 mt -88.41 -6.37 57.71 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.782 1.233 . . . . 0.0 112.168 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.9 t -83.24 -50.29 8.56 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 126.46 1.904 . . . . 0.0 109.081 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.92 9.37 6.56 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.879 1.271 . . . . 0.0 113.1 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -76.58 78.23 3.26 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.942 1.697 . . . . 0.0 113.448 -172.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.55 -0.78 0.07 Allowed 'General case' 0 CA--C 1.534 0.33 1 C-N-CA 131.797 4.039 . . . . 0.0 113.526 174.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.7 -26.92 36.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.044 2.138 . . . . 0.0 111.49 174.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -112.73 -50.69 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 125.84 1.656 . . . . 0.0 110.72 175.1 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 42.97 47.19 4.9 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.571 1.948 . . . . 0.0 113.306 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.0 173.01 16.57 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 174.345 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -131.28 -19.96 2.74 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 127.19 2.196 . . . . 0.0 111.809 177.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.88 -56.13 3.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.211 2.204 . . . . 0.0 106.902 173.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 65.2 mt -59.06 -28.33 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.087 0.555 . . . . 0.0 109.75 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.11 -40.15 67.04 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.564 1.145 . . . . 0.0 111.937 176.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -49.97 65.78 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.362 0.983 . . . . 0.0 109.588 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -62.31 -46.57 88.13 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.768 0.427 . . . . 0.0 110.448 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.7 m -66.29 -30.64 71.11 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.604 1.161 . . . . 0.0 110.253 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -69.7 -46.14 66.66 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 119.632 1.106 . . . . 0.0 108.985 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 56.7 m -61.25 -41.08 96.28 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.273 0.488 . . . . 0.0 110.315 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.6 -47.46 86.1 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.997 0.919 . . . . 0.0 111.074 174.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 20.5 t -63.7 -44.9 92.28 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.156 -0.965 . . . . 0.0 111.963 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.02 -50.92 69.56 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.44 -0.79 . . . . 0.0 109.74 175.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -54.77 -44.52 73.77 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.12 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -66.7 -35.57 80.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 119.868 1.213 . . . . 0.0 111.044 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -49.12 71.28 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 174.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.446 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.3 m-85 -64.18 -47.09 81.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.687 0.676 . . . . 0.0 111.303 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.75 -49.05 69.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.419 2.687 . . . . 0.0 108.53 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 23.2 t -58.68 -42.66 89.02 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.708 -0.62 . . . . 0.0 111.48 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.47 HD21 ' HG ' ' A' ' 479' ' ' LEU . 60.2 mt -71.61 -32.33 67.89 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 119.165 0.893 . . . . 0.0 110.155 -175.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.7 mt -70.85 -41.05 71.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.618 0.767 . . . . 0.0 109.118 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.29 -50.58 71.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.002 0.921 . . . . 0.0 109.184 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 51.7 mt -57.83 -39.06 76.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.206 1.003 . . . . 0.0 110.448 174.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -61.84 -42.94 99.66 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 118.103 -0.951 . . . . 0.0 108.771 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.4 tt0 -61.61 -41.34 97.33 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 116.108 -1.901 . . . . 0.0 110.368 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.37 -46.0 90.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.177 2.262 . . . . 0.0 109.811 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -63.17 -39.09 93.64 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -174.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.58 -51.46 42.33 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.956 1.302 . . . . 0.0 111.388 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.8 mm -64.16 -36.62 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 119.536 1.062 . . . . 0.0 109.123 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.45 -33.61 75.94 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.335 -1.478 . . . . 0.0 111.48 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 52.0 mtt-85 -61.14 -32.43 72.13 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 116.331 -1.795 . . . . 0.0 109.323 173.912 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -57.22 -42.29 81.08 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 121.402 1.91 . . . . 0.0 110.527 176.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.94 3.65 7.9 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -177.187 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.497 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.92 -85.89 0.09 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.417 1.008 . . . . 0.0 108.934 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.497 ' H ' HG23 ' A' ' 560' ' ' THR . 3.2 m-70 -47.4 -41.32 19.71 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.994 2.118 . . . . 0.0 113.558 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.8 101.16 1.21 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.15 132.61 54.54 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 173.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 170.58 13.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 122.918 1.342 . . . . 0.0 109.249 176.225 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -40.02 94.86 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.804 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -46.63 60.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.706 1.879 . . . . 0.0 109.124 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -65.39 -35.27 80.44 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.517 1.053 . . . . 0.0 111.598 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.4 ' HA ' HD12 ' A' ' 571' ' ' LEU . 9.7 ttm180 -63.01 -31.75 72.96 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 120.595 -1.315 . . . . 0.0 109.472 174.611 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 5.0 mp -78.23 -32.3 49.71 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.458 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.49 -43.38 84.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.699 1.59 . . . . 0.0 107.671 173.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 568' ' ' ARG . 3.4 mt -58.22 -39.84 80.08 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-O 116.481 -1.723 . . . . 0.0 113.269 175.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -62.38 -40.68 97.26 Favored 'General case' 0 C--N 1.345 0.413 0 CA-C-N 122.383 2.356 . . . . 0.0 109.095 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -41.63 76.55 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -40.21 87.6 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.595 -1.315 . . . . 0.0 110.77 174.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.9 m120 -57.93 -42.98 86.0 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.758 1.223 . . . . 0.0 110.331 174.031 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.43 -27.8 52.36 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.295 1.407 . . . . 0.0 111.375 -176.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.47 -42.29 83.22 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 22.8 mt -78.81 -23.8 44.91 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 118.7 0.682 . . . . 0.0 110.887 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -59.51 -29.85 68.16 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.744 -0.597 . . . . 0.0 111.948 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp 49.43 -71.95 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 129.771 3.228 . . . . 0.0 114.16 173.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt . . . . . 0 CA--C 1.533 0.322 0 O-C-N 119.965 -1.71 . . . . 0.0 106.754 173.813 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 9.3 tptt . . . . . 0 C--O 1.236 0.375 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.39 158.51 1.12 Allowed 'General case' 0 CA--C 1.505 -0.778 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -173.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 449' ' ' THR . . . . . 0.767 HG21 ' HA ' ' A' ' 538' ' ' SER . 10.8 t -163.79 158.53 20.23 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 173.811 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -130.52 164.03 25.76 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.782 1.633 . . . . 0.0 107.372 -174.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -52.65 -19.02 2.07 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.7 mmm-85 -59.75 -39.68 85.58 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-O 118.179 -0.915 . . . . 0.0 109.61 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 mm -67.98 -43.83 85.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.147 0 CA-C-O 115.146 -2.359 . . . . 0.0 108.873 176.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.631 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 2.9 mm? -59.05 -54.51 46.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.47 1.941 . . . . 0.0 108.694 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.436 HG23 HD13 ' A' ' 488' ' ' LEU . 25.6 mt -59.97 -59.63 3.74 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 124.266 1.026 . . . . 0.0 111.098 177.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.36 -29.32 71.17 Favored Glycine 0 N--CA 1.468 0.787 0 CA-C-N 120.847 1.658 . . . . 0.0 113.551 -173.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.589 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.1 OUTLIER -71.34 -45.89 61.87 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.457 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.44 -32.12 73.47 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 127.415 2.286 . . . . 0.0 110.83 175.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 503' ' ' LEU . 18.6 t -66.67 -55.08 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 124.654 1.182 . . . . 0.0 108.201 174.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 460' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 500' ' ' THR . 76.5 mt-30 -72.2 -17.73 61.91 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 118.707 -0.663 . . . . 0.0 112.461 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.448 ' HB3' HD12 ' A' ' 464' ' ' LEU . 53.0 t-20 -146.29 80.62 10.01 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 127.164 2.186 . . . . 0.0 110.68 -174.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.6 -20.92 34.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.207 1.938 . . . . 0.0 112.296 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -66.92 -18.92 65.61 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.929 0.892 . . . . 0.0 110.039 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 461' ' ' ASN . 43.9 mt -63.85 -12.09 33.27 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.953 1.706 . . . . 0.0 110.179 173.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.94 87.93 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 119.015 0.825 . . . . 0.0 109.818 173.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 61.3 m -69.21 -13.28 62.32 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.899 0.772 . . . . 0.0 111.967 174.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.71 -15.91 20.16 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.403 1.002 . . . . 0.0 112.573 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -80.26 146.49 62.47 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.87 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -74.33 169.06 23.35 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.829 3.019 . . . . 0.0 112.072 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.83 0.51 5.59 Favored 'Trans proline' 0 CA--C 1.552 1.381 0 C-N-CA 122.703 2.269 . . . . 0.0 114.819 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.879 HD22 HD11 ' A' ' 482' ' ' LEU 0.286 1.2 mp 76.04 39.92 0.28 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 130.063 3.345 . . . . 0.0 115.816 177.225 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.68 -51.55 48.33 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.299 1.44 . . . . 0.0 114.108 -178.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.72 2.49 19.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.004 -1.685 . . . . 0.0 111.732 174.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.53 HD21 ' CE1' ' A' ' 543' ' ' PHE . 5.8 mp -112.4 -74.29 0.64 Allowed 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 123.375 0.67 . . . . 0.0 111.083 -173.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 5.9 t70 60.06 169.24 0.08 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.928 1.823 . . . . 0.0 110.348 -173.078 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -84.23 -24.4 30.05 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 125.823 1.649 . . . . 0.0 108.886 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -56.12 -48.43 76.22 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 126.397 1.879 . . . . 0.0 108.609 173.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -74.81 -32.04 61.87 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 119.012 -1.075 . . . . 0.0 111.99 -174.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.42 ' CD1' HD21 ' A' ' 546' ' ' LEU . 17.0 mt -131.09 115.92 16.61 Favored Pre-proline 0 C--O 1.225 -0.214 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -173.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.25 -51.47 0.34 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 CA-C-N 120.67 1.275 . . . . 0.0 111.739 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -67.08 -19.9 70.44 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.862 1.22 . . . . 0.0 112.207 -177.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.879 HD11 HD22 ' A' ' 471' ' ' LEU . 1.4 tm? -61.15 -33.5 73.51 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.567 1.547 . . . . 0.0 110.418 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.35 -47.86 6.9 Favored Glycine 0 CA--C 1.527 0.814 0 O-C-N 123.833 0.708 . . . . 0.0 111.844 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.8 -41.35 91.03 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.133 0.973 . . . . 0.0 112.315 176.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.631 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 41.2 t80 -66.81 -51.17 58.88 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.578 1.535 . . . . 0.0 109.777 174.328 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -55.63 -47.31 76.82 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 118.449 0.568 . . . . 0.0 111.0 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.48 -39.99 92.59 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.891 0.876 . . . . 0.0 110.792 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.477 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -64.06 -47.6 79.53 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.85 1.26 . . . . 0.0 112.484 174.472 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 468' ' ' VAL . 49.4 t -59.0 -49.45 83.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.465 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -55.33 -44.11 75.59 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.662 1.185 . . . . 0.0 108.944 -176.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 55.0 m -63.01 -43.86 97.59 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.671 2.389 . . . . 0.0 111.837 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.6 m -63.6 -44.06 95.11 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.251 0.932 . . . . 0.0 109.457 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -16.99 64.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.71 1.204 . . . . 0.0 111.229 173.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.68 -16.44 26.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.753 1.221 . . . . 0.0 112.293 176.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -122.26 82.45 45.48 Favored Pre-proline 0 CA--C 1.536 0.427 0 C-N-CA 124.848 1.259 . . . . 0.0 107.796 175.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -63.57 139.38 69.72 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 N-CA-C 108.114 -1.533 . . . . 0.0 108.114 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 78.69 15.45 80.76 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 118.394 -1.225 . . . . 0.0 113.996 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.05 166.4 4.73 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 120.079 1.939 . . . . 0.0 109.183 173.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.7 p -140.93 163.01 34.12 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 119.569 -1.957 . . . . 0.0 108.982 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.493 HG23 ' HA ' ' A' ' 460' ' ' GLN . 7.4 m -47.63 -41.72 22.68 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.333 1.453 . . . . 0.0 112.469 174.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -85.02 -50.38 4.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -58.0 -24.19 57.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.007 1.723 . . . . 0.0 112.119 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 459' ' ' VAL . 59.1 tp -58.6 -48.29 81.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.657 1.117 . . . . 0.0 108.865 173.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.46 -29.39 68.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.847 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.93 -43.78 78.37 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.615 0.766 . . . . 0.0 109.991 174.385 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.26 -21.13 61.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.77 1.168 . . . . 0.0 112.868 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -111.53 11.84 21.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.908 0.883 . . . . 0.0 110.163 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.76 126.59 24.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 120.477 -1.39 . . . . 0.0 110.832 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.97 15.39 81.22 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 118.704 -1.053 . . . . 0.0 114.501 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.753 HG22 ' H ' ' A' ' 512' ' ' ASN . 75.2 m -93.1 148.23 22.18 Favored 'General case' 0 C--O 1.246 0.893 0 CA-C-N 119.222 1.511 . . . . 0.0 108.083 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -58.29 -25.34 61.7 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.172 -0.955 . . . . 0.0 111.134 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.753 ' H ' HG22 ' A' ' 510' ' ' THR . 0.7 OUTLIER -89.61 -17.94 27.5 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.278 2.231 . . . . 0.0 112.183 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.87 -49.42 62.95 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.917 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.36 -43.79 54.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.338 0.972 . . . . 0.0 112.567 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 78.9 m -60.58 -51.33 69.88 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.477 HD21 HD11 ' A' ' 488' ' ' LEU . 76.4 mt -57.13 -44.57 83.45 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 125.541 1.536 . . . . 0.0 112.512 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.53 -39.62 88.7 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.641 1.976 . . . . 0.0 109.137 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -37.46 84.71 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 78.7 mt -82.72 -9.53 59.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.641 0.776 . . . . 0.0 112.315 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.8 t -76.24 -59.88 2.57 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 0.0 107.583 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.35 22.58 0.67 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.784 2.034 . . . . 0.0 112.777 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.5 t90 -73.03 114.71 11.49 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -173.242 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.17 7.95 43.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 128.413 2.685 . . . . 0.0 114.595 -173.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -70.89 -40.0 72.48 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.441 -1.412 . . . . 0.0 109.13 173.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.589 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.3 pt -108.38 -70.67 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 127.361 2.264 . . . . 0.0 110.73 -174.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.12 37.79 11.57 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.76 2.024 . . . . 0.0 114.798 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -129.36 -178.74 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.5 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -137.07 -24.68 1.1 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.151 2.18 . . . . 0.0 112.301 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -91.18 -54.79 3.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.007 2.123 . . . . 0.0 108.073 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -62.35 -22.02 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.54 -52.75 63.59 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.279 1.4 . . . . 0.0 111.46 174.166 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -62.34 -42.21 99.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.301 1.41 . . . . 0.0 110.68 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -53.32 51.91 Favored 'General case' 0 C--N 1.34 0.184 0 O-C-N 122.025 -0.422 . . . . 0.0 111.079 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 33.5 m -61.26 -33.77 74.08 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.236 -1.364 . . . . 0.0 110.664 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.48 ' HB2' HD12 ' A' ' 457' ' ' LEU . 41.4 t80 -64.23 -49.32 72.42 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 121.242 1.837 . . . . 0.0 109.786 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.3 m -62.41 -45.31 93.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.411 1.084 . . . . 0.0 111.159 178.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.87 -43.79 98.13 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.12 1.368 . . . . 0.0 110.694 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.767 ' HA ' HG21 ' A' ' 449' ' ' THR . 6.0 t -67.56 -45.9 74.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 124.319 1.048 . . . . 0.0 112.616 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.0 tt -54.92 -51.74 65.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -55.52 -44.53 76.75 Favored 'General case' 0 C--O 1.205 -1.245 0 C-N-CA 124.754 1.221 . . . . 0.0 111.327 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -63.3 -38.88 92.9 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.051 0.841 . . . . 0.0 112.053 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.3 -51.42 68.96 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.889 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.537 ' HA ' HD12 ' A' ' 546' ' ' LEU . 2.5 m-85 -58.1 -48.35 80.45 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.849 0.86 . . . . 0.0 111.406 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -57.52 -41.44 80.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.721 2.009 . . . . 0.0 109.495 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.5 t -56.73 -36.58 69.89 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.711 -1.243 . . . . 0.0 112.455 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 543' ' ' PHE . 14.1 mt -81.99 -35.59 28.78 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 124.747 1.219 . . . . 0.0 109.284 -176.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -40.81 91.61 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.218 1.407 . . . . 0.0 108.766 174.152 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -59.68 -55.68 31.31 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.718 1.607 . . . . 0.0 108.429 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 18.5 mt -52.61 -47.58 66.87 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.491 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -64.36 -44.07 92.57 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.86 1.209 . . . . 0.0 110.128 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.33 -49.29 67.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.154 0.982 . . . . 0.0 108.88 173.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.27 -40.68 86.18 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.176 0.444 . . . . 0.0 110.336 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -54.78 -48.28 72.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.917 1.287 . . . . 0.0 108.969 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.412 ' HB2' HD21 ' A' ' 571' ' ' LEU . 5.1 mt -61.86 -52.73 62.92 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.685 1.594 . . . . 0.0 110.066 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.8 mm -63.69 -35.95 74.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 121.88 2.127 . . . . 0.0 111.239 177.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.88 73.19 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 120.964 -1.085 . . . . 0.0 109.81 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 15.5 mtm180 -92.39 -3.64 54.99 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 116.724 -1.608 . . . . 0.0 111.223 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.47 -60.87 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 122.718 2.508 . . . . 0.0 105.151 173.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -14.52 62.84 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -173.342 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 62.2 p -114.01 -61.42 1.75 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 120.81 1.641 . . . . 0.0 109.631 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -82.25 -35.79 27.8 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.068 1.347 . . . . 0.0 113.733 -175.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 77.42 80.47 0.66 Allowed Glycine 0 C--N 1.338 0.688 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 -173.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 167.1 1.54 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 173.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 8.4 t -70.19 157.89 36.81 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 120.29 -1.506 . . . . 0.0 108.949 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -38.36 75.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.27 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -63.31 -51.86 64.28 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.322 1.049 . . . . 0.0 111.094 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -53.75 -40.88 66.55 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.534 1.061 . . . . 0.0 111.361 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' A' ' 571' ' ' LEU . 4.5 tmt_? -60.93 -39.37 89.19 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.392 -1.443 . . . . 0.0 109.981 176.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 7.7 mp -72.79 -33.96 66.61 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 116.937 -1.506 . . . . 0.0 110.962 175.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.63 -43.74 62.7 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.446 1.475 . . . . 0.0 108.967 174.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' A' ' 568' ' ' ARG . 1.6 mt -57.06 -39.22 74.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -41.24 92.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 121.442 1.928 . . . . 0.0 108.157 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -35.48 80.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 122.442 0.297 . . . . 0.0 111.369 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.05 -41.35 70.9 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.578 -1.326 . . . . 0.0 109.99 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -60.24 -37.64 81.01 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.992 -1.067 . . . . 0.0 111.246 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -71.54 -32.81 68.56 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.594 1.088 . . . . 0.0 111.019 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -66.74 -40.69 88.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.08 0.952 . . . . 0.0 110.318 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 mt -83.51 -18.71 37.53 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.147 -0.97 . . . . 0.0 108.791 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -66.89 -29.91 69.93 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 119.944 -1.723 . . . . 0.0 113.345 174.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? 14.98 92.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.807 2.843 . . . . 0.0 114.642 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt . . . . . 0 N--CA 1.477 0.92 0 C-N-CA 126.424 1.89 . . . . 0.0 110.839 -178.589 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.162 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.49 154.74 47.77 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.333 -2.099 . . . . 0.0 105.333 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 93.5 m -62.76 151.7 37.88 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 124.136 0.974 . . . . 0.0 109.678 174.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 5.5 t -82.16 167.06 19.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.852 1.261 . . . . 0.0 110.086 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.37 47.02 0.99 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -120.53 -42.92 2.52 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.888 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 4.8 mm -68.94 -52.22 36.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.642 0 CA-C-O 117.6 -1.19 . . . . 0.0 108.788 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.1 mt -54.23 -50.17 67.76 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 120.405 1.457 . . . . 0.0 110.595 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.468 HG22 ' HG ' ' A' ' 519' ' ' LEU . 81.9 mt -64.58 -55.6 20.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.163 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.98 -44.1 92.88 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 120.045 1.293 . . . . 0.0 112.815 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.675 HD21 HG21 ' A' ' 525' ' ' ILE . 50.9 mt -65.26 -50.28 66.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.459 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.82 -34.42 74.51 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.963 0.801 . . . . 0.0 111.744 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.64 -48.85 84.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 120.899 -1.125 . . . . 0.0 109.679 175.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -79.12 -17.11 55.67 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.918 -0.489 . . . . 0.0 111.685 175.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.563 ' HB3' HD12 ' A' ' 464' ' ' LEU . 24.9 t-20 -131.42 70.96 81.78 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-N 119.637 1.108 . . . . 0.0 109.198 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.85 -18.89 53.06 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.704 1.603 . . . . 0.0 111.576 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -67.45 -23.0 65.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.925 0.89 . . . . 0.0 110.605 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 461' ' ' ASN . 63.2 mt -62.12 -12.51 19.89 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 120.867 -1.145 . . . . 0.0 110.356 173.694 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -59.7 -39.79 85.74 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.946 1.248 . . . . 0.0 111.673 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 53.6 m -77.17 -13.96 59.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 120.163 1.347 . . . . 0.0 111.993 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.3 mt -90.73 -19.27 23.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.356 1.063 . . . . 0.0 112.516 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -81.77 149.21 63.34 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.851 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 468' ' ' VAL . 17.0 Cg_endo -69.36 173.99 9.81 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.142 3.228 . . . . 0.0 112.08 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -75.06 5.21 4.15 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 124.046 3.164 . . . . 0.0 114.048 175.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.904 HD23 HD21 ' A' ' 482' ' ' LEU . 7.1 mp 67.62 53.61 0.7 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.954 2.502 . . . . 0.0 111.675 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.51 -65.66 0.9 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.95 1.3 . . . . 0.0 108.95 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.3 -12.17 60.62 Favored 'General case' 0 C--N 1.344 0.369 0 O-C-N 120.969 -1.082 . . . . 0.0 111.775 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.665 HD12 ' HG ' ' A' ' 471' ' ' LEU . 22.4 mt -82.49 -77.14 0.24 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.2 t0 65.83 150.87 0.05 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.064 1.746 . . . . 0.0 111.999 -174.242 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.2 -10.01 59.14 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 120.325 -1.484 . . . . 0.0 111.313 178.258 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -82.09 -37.39 26.41 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.141 0.976 . . . . 0.0 111.102 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -85.23 -29.51 24.6 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 118.508 -0.758 . . . . 0.0 110.414 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.623 HD21 HD11 ' A' ' 546' ' ' LEU . 3.6 mm? -116.16 89.44 25.6 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.475 1.11 . . . . 0.0 109.138 -174.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.9 87.04 0.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.293 3.328 . . . . 0.0 110.146 -176.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 135.09 -15.57 4.25 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.767 1.651 . . . . 0.0 112.86 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.904 HD21 HD23 ' A' ' 471' ' ' LEU . 0.9 OUTLIER -64.05 -25.95 68.34 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-O 116.968 -1.492 . . . . 0.0 110.962 173.827 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.99 -40.47 12.72 Favored Glycine 0 C--O 1.218 -0.866 0 CA-C-N 119.68 1.127 . . . . 0.0 111.39 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 35.2 tp -61.33 -43.02 99.58 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.82 1.31 . . . . 0.0 112.504 176.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -66.34 -47.59 73.0 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.35 1.06 . . . . 0.0 110.527 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.537 ' HG3' HD22 ' A' ' 471' ' ' LEU . 65.6 ttt-85 -58.73 -51.13 71.28 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.197 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -43.31 99.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 123.83 0.707 . . . . 0.0 110.297 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.434 HD13 HG23 ' A' ' 455' ' ' ILE . 0.9 OUTLIER -57.82 -49.01 78.08 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 123.56 0.744 . . . . 0.0 111.609 179.143 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.67 HG11 ' CG1' ' A' ' 468' ' ' VAL . 71.9 t -62.35 -48.19 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.238 175.189 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -53.65 -45.76 70.33 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.907 1.683 . . . . 0.0 108.558 -176.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 3.0 m -66.47 -45.73 78.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.401 1.88 . . . . 0.0 110.359 173.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 87.5 m -57.88 -40.3 79.93 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 121.352 1.887 . . . . 0.0 112.065 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.7 -24.5 67.59 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.36 1.464 . . . . 0.0 111.774 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -49.72 12.85 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.363 0.665 . . . . 0.0 110.172 174.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -73.84 102.45 0.62 Allowed Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 124.291 1.036 . . . . 0.0 110.584 -173.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.41 124.35 11.95 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 109.626 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.73 41.98 99.76 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 123.853 0.74 . . . . 0.0 111.379 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 24.9 tp -61.13 156.17 18.84 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.528 0.68 . . . . 0.0 110.083 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.57 165.42 21.75 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.0 m -54.52 -43.25 71.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.448 1.499 . . . . 0.0 110.943 176.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -78.3 -39.14 23.63 Favored Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.42 -26.81 68.14 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.084 0.553 . . . . 0.0 111.849 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 38.2 tp -60.12 -52.68 64.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.615 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.0 mm? -65.11 -31.44 72.64 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 122.053 -0.404 . . . . 0.0 111.745 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -44.12 79.14 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.321 1.048 . . . . 0.0 110.442 175.446 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -61.16 -17.31 52.3 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.833 -1.167 . . . . 0.0 112.714 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -113.73 16.29 18.57 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.785 2.034 . . . . 0.0 110.141 177.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -58.44 133.21 55.57 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 119.837 -1.789 . . . . 0.0 109.149 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 69.93 27.97 72.43 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.038 -0.413 . . . . 0.0 112.581 173.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.774 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.6 m -108.14 145.91 33.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -61.72 -12.04 14.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.794 1.237 . . . . 0.0 112.062 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.774 ' H ' HG22 ' A' ' 510' ' ' THR . 4.8 m120 -107.55 -14.13 14.91 Favored 'General case' 0 C--N 1.372 1.555 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 -174.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -48.82 -51.33 30.02 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 120.394 1.452 . . . . 0.0 110.021 172.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.42 -43.26 54.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.374 1.47 . . . . 0.0 113.534 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 17.5 m -64.86 -54.07 36.83 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.417 HD21 HD11 ' A' ' 488' ' ' LEU . 9.6 mt -56.1 -34.2 65.8 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 124.278 1.031 . . . . 0.0 111.684 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.37 -39.95 92.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 126.417 1.887 . . . . 0.0 107.853 176.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -63.44 -29.74 70.97 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.126 1.33 . . . . 0.0 112.114 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.468 ' HG ' HG22 ' A' ' 455' ' ' ILE . 3.5 mm? -86.84 -41.82 13.74 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 125.954 1.702 . . . . 0.0 110.874 177.014 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 520' ' ' SER . . . . . 0.615 ' HB2' HD21 ' A' ' 504' ' ' LEU . 14.5 t -61.29 -49.84 75.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.508 1.123 . . . . 0.0 110.323 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -71.9 -7.59 49.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 126.198 1.799 . . . . 0.0 112.729 175.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -72.89 131.21 41.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.46 14.86 7.13 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.062 1.745 . . . . 0.0 109.506 -173.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -61.23 -24.99 66.76 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.042 1.737 . . . . 0.0 110.464 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.675 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -99.1 -59.45 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 128.564 2.746 . . . . 0.0 109.403 175.279 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.37 30.54 1.58 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.253 2.221 . . . . 0.0 112.656 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -140.41 165.52 27.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.672 1.189 . . . . 0.0 108.847 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -126.52 -30.42 2.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.628 2.371 . . . . 0.0 111.142 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -79.83 -57.03 3.85 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.737 1.615 . . . . 0.0 107.74 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 51.3 mt -59.72 -28.87 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.523 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.79 -58.85 6.55 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.869 -1.062 . . . . 0.0 109.426 173.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.54 -42.72 75.0 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 120.387 1.449 . . . . 0.0 110.777 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -63.6 -55.19 25.66 Favored 'General case' 0 C--O 1.22 -0.456 0 O-C-N 121.85 -0.532 . . . . 0.0 110.303 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 98.3 m -64.02 -26.9 68.77 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.258 1.423 . . . . 0.0 110.239 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.427 ' CG ' HD13 ' A' ' 464' ' ' LEU . 86.4 t80 -64.42 -59.08 4.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.582 1.083 . . . . 0.0 109.151 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 55.8 m -60.56 -44.92 95.63 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.771 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.05 -44.71 94.48 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.667 1.121 . . . . 0.0 110.777 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 25.7 t -66.16 -49.81 66.11 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.799 2.04 . . . . 0.0 110.556 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.31 -53.6 42.19 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 123.839 0.856 . . . . 0.0 110.76 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.323 1.2 m-20 -64.25 -30.92 71.95 Favored 'General case' 0 N--CA 1.418 -2.045 0 C-N-CA 118.236 -1.385 . . . . 0.0 110.436 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -70.64 -31.56 68.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.148 1.34 . . . . 0.0 110.717 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -55.69 9.53 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.556 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.8 m-85 -56.39 -48.17 77.43 Favored 'General case' 0 C--N 1.347 0.463 0 C-N-CA 123.727 0.811 . . . . 0.0 109.568 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.5 -46.22 90.92 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.269 2.228 . . . . 0.0 110.655 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 34.9 t -51.56 -45.54 63.1 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.03 -0.419 . . . . 0.0 110.132 174.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.623 HD11 HD21 ' A' ' 479' ' ' LEU . 12.0 mt -74.0 -38.95 63.94 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.173 -176.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -47.0 87.11 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.78 -50.54 71.94 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.328 1.451 . . . . 0.0 110.974 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.61 -46.88 87.94 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.296 1.038 . . . . 0.0 109.834 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' ARG . . . . . 0.408 ' O ' HD12 ' A' ' 554' ' ' LEU . 1.5 ttm-85 -64.48 -45.84 85.63 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.518 1.127 . . . . 0.0 109.25 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.05 -53.31 52.13 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.538 1.135 . . . . 0.0 109.333 175.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -58.61 -43.91 89.78 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 117.445 -1.264 . . . . 0.0 110.097 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -50.14 74.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.723 1.209 . . . . 0.0 110.037 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.743 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.6 mt -58.37 -53.33 59.53 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.073 1.349 . . . . 0.0 108.527 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.7 mm -65.02 -39.65 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.344 1.058 . . . . 0.0 110.891 -178.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.01 -33.11 72.75 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.146 2.178 . . . . 0.0 108.258 176.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.36 -2.27 58.5 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 116.143 -1.884 . . . . 0.0 110.8 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -89.41 -44.81 9.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 122.757 2.526 . . . . 0.0 109.622 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -68.63 -3.34 11.54 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 120.603 -1.311 . . . . 0.0 114.099 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.6 OUTLIER -138.65 -87.98 0.23 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 119.469 1.031 . . . . 0.0 109.071 -175.376 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.645 ' H ' HG23 ' A' ' 560' ' ' THR . 8.6 m-70 -55.77 -27.58 51.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.536 1.934 . . . . 0.0 113.385 -178.411 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 61.37 83.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 126.499 1.999 . . . . 0.0 109.575 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.53 160.63 0.16 Allowed 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.073 0.949 . . . . 0.0 109.942 173.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.68 163.14 11.95 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.252 -1.379 . . . . 0.0 111.028 -176.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -55.04 -42.23 72.38 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.171 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.95 -50.33 69.06 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 124.806 1.242 . . . . 0.0 110.922 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -56.89 -38.62 73.04 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.174 1.352 . . . . 0.0 111.842 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.592 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -67.73 -38.84 84.08 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.83 -1.169 . . . . 0.0 109.748 176.544 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.06 -37.25 85.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.999 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.43 -43.08 75.01 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 124.708 1.203 . . . . 0.0 107.765 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 554' ' ' LEU . 3.5 mt -58.39 -41.12 84.16 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.575 1.15 . . . . 0.0 113.692 174.065 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -46.87 88.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -58.85 -44.51 91.03 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 124.675 1.235 . . . . 0.0 108.462 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -46.73 86.55 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.493 1.517 . . . . 0.0 113.131 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -62.1 -42.44 99.22 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.702 1.601 . . . . 0.0 110.204 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -72.43 -24.17 61.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 117.276 -1.345 . . . . 0.0 112.065 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.21 -37.07 61.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.711 1.205 . . . . 0.0 108.874 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 10.8 mt -80.47 -13.57 59.01 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.186 -1.571 . . . . 0.0 113.093 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 35.43 76.62 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 130.357 3.463 . . . . 0.0 111.186 175.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.86 93.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.15 1.38 . . . . 0.0 113.136 -178.113 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt . . . . . 0 N--CA 1.469 0.495 0 CA-C-O 122.746 1.26 . . . . 0.0 109.727 175.267 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.3 tttt . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 121.448 0.642 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.59 160.85 31.12 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 173.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 46.65 -144.99 0.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.069 1.347 . . . . 0.0 108.653 -174.204 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.71 117.74 8.85 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 120.902 1.683 . . . . 0.0 110.324 173.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.0 mtt -75.86 40.85 0.2 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.438 1.495 . . . . 0.0 110.443 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -128.74 -42.08 1.45 Allowed 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 126.988 2.115 . . . . 0.0 108.765 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.4 mm -56.85 -52.41 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.278 0 CA-C-N 119.607 1.094 . . . . 0.0 109.039 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 34.8 mt -53.6 -33.12 53.82 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 82.0 mt -79.43 -54.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 C-N-CA 124.069 0.948 . . . . 0.0 110.208 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.17 -36.97 93.19 Favored Glycine 0 CA--C 1.523 0.546 0 CA-C-N 119.635 1.107 . . . . 0.0 111.692 -174.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -48.42 71.7 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.661 174.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.48 -31.25 69.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.459 1.103 . . . . 0.0 111.451 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.3 t -64.78 -57.78 9.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.314 1.046 . . . . 0.0 108.852 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.35 -32.4 73.99 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.226 -178.09 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -131.48 87.4 46.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 126.069 1.747 . . . . 0.0 109.652 -174.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.33 -17.99 39.24 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.504 1.469 . . . . 0.0 113.23 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -61.28 -22.51 64.92 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.064 1.302 . . . . 0.0 110.731 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.509 HD22 ' CD2' ' A' ' 535' ' ' PHE . 76.9 mt -57.05 -19.14 17.31 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.106 0.962 . . . . 0.0 112.205 174.137 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.1 -26.04 68.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.737 0.699 . . . . 0.0 112.462 174.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 85.6 m -83.9 -19.85 34.04 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.816 0.847 . . . . 0.0 111.069 174.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 9.6 mt -87.45 -14.75 39.62 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.452 0.701 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -82.68 140.93 44.25 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.795 1.179 . . . . 0.0 109.749 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.81 164.91 17.45 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.421 2.747 . . . . 0.0 110.817 173.636 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -65.93 8.95 0.24 Allowed 'Trans proline' 0 CA--C 1.549 1.265 0 C-N-CA 124.871 3.714 . . . . 0.0 115.866 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.42 HD13 HD12 ' A' ' 474' ' ' LEU . 1.0 OUTLIER 90.49 -0.13 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 132.256 4.222 . . . . 0.0 113.535 175.118 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -34.52 -58.23 0.49 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.611 2.364 . . . . 0.0 115.724 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -98.07 2.76 49.07 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.42 HD12 HD13 ' A' ' 471' ' ' LEU . 80.8 mt -85.11 -65.66 0.98 Allowed 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.943 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 24.5 t0 57.88 118.8 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.446 1.898 . . . . 0.0 111.172 -173.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.92 -27.33 65.16 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.296 -1.502 . . . . 0.0 111.285 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -68.93 -23.58 64.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 117.548 -1.215 . . . . 0.0 112.206 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -84.93 -20.02 31.3 Favored 'General case' 0 C--N 1.348 0.529 0 CA-C-N 121.337 1.88 . . . . 0.0 111.393 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 546' ' ' LEU . 1.2 mt -128.98 91.85 41.46 Favored Pre-proline 0 C--O 1.235 0.318 0 CA-C-N 119.364 0.984 . . . . 0.0 111.309 -173.235 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.16 85.23 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 124.114 3.209 . . . . 0.0 111.618 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.03 -22.33 2.45 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 125.505 1.526 . . . . 0.0 112.066 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.74 -32.09 68.91 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.963 1.382 . . . . 0.0 110.524 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -53.05 -32.55 42.7 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.301 0.955 . . . . 0.0 113.836 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 1.6 tt -63.25 -44.35 95.42 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 119.584 1.692 . . . . 0.0 110.763 173.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -66.02 -39.6 90.36 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.671 0.789 . . . . 0.0 110.333 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.48 76.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 118.499 0.59 . . . . 0.0 110.255 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.94 -56.56 18.26 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.821 1.648 . . . . 0.0 108.186 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.57 -52.85 53.07 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.212 1.405 . . . . 0.0 111.964 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 468' ' ' VAL . 43.8 t -58.41 -42.49 84.29 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 CA-C-N 119.684 1.129 . . . . 0.0 109.931 178.442 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.58 -47.95 80.72 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.989 0.813 . . . . 0.0 109.818 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 94.2 m -63.0 -40.45 97.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.732 2.013 . . . . 0.0 110.51 176.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.5 m -64.64 -39.64 94.05 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 120.927 -1.108 . . . . 0.0 110.448 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.76 -16.86 64.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.966 0.906 . . . . 0.0 112.19 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.6 -41.16 12.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.739 1.615 . . . . 0.0 112.194 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -79.33 109.62 12.1 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 120.145 1.339 . . . . 0.0 110.1 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.75 108.96 2.68 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 121.217 1.278 . . . . 0.0 109.661 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.85 54.97 5.57 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.09 0.853 . . . . 0.0 111.705 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.1 165.76 8.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.411 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.93 168.31 20.06 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 176.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.4 m -49.24 -51.68 31.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.242 1.417 . . . . 0.0 110.152 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -79.37 -37.12 25.08 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -174.615 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.47 -31.43 72.58 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.253 0.621 . . . . 0.0 109.995 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 62.6 tp -60.48 -51.97 67.2 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 124.096 0.958 . . . . 0.0 110.349 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.44 -36.08 75.25 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 118.965 -0.54 . . . . 0.0 109.841 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.13 -38.95 75.69 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.318 0.508 . . . . 0.0 110.653 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -69.8 -21.22 63.42 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.663 0.665 . . . . 0.0 112.121 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -105.89 8.65 32.72 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.169 -1.582 . . . . 0.0 109.015 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -54.45 120.66 6.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 119.542 -1.974 . . . . 0.0 111.409 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 88.89 10.2 67.08 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.207 -0.774 . . . . 0.0 113.376 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.82 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.0 m -92.26 152.49 19.79 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.941 1.371 . . . . 0.0 108.028 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.17 -16.25 42.57 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 121.259 -0.901 . . . . 0.0 112.448 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.82 ' H ' HG22 ' A' ' 510' ' ' THR . 7.9 t-20 -93.93 -15.12 25.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.133 0.973 . . . . 0.0 111.103 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -53.75 -49.31 68.45 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.079 0.854 . . . . 0.0 110.461 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.89 58.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.739 0.699 . . . . 0.0 112.581 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 90.7 m -66.29 -44.79 82.51 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.894 -0.504 . . . . 0.0 110.285 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.22 -37.59 88.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.425 0.69 . . . . 0.0 111.011 178.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -62.08 -49.34 76.34 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.695 1.998 . . . . 0.0 108.531 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -55.06 -42.04 72.22 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.57 0.748 . . . . 0.0 110.952 174.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 87.7 mt -79.24 -13.56 59.6 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.476 0.71 . . . . 0.0 112.332 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 5.5 t -75.5 -51.64 12.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.19 0.996 . . . . 0.0 108.814 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 1.3 ptm -87.45 33.26 0.69 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 127.14 2.176 . . . . 0.0 111.135 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -88.02 94.92 9.94 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.394 1.092 . . . . 0.0 113.269 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -62.71 -7.8 5.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 128.175 2.59 . . . . 0.0 113.364 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.08 -13.96 62.15 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.564 1.945 . . . . 0.0 112.153 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 2.5 pt -137.87 -60.36 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.234 1.814 . . . . 0.0 110.304 -176.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 53.85 0.86 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.92 3.288 . . . . 0.0 117.822 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 527' ' ' ASP . . . . . 0.535 ' CG ' ' H ' ' A' ' 528' ' ' LYS . 28.6 t70 -108.47 -173.84 2.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.759 1.163 . . . . 0.0 112.795 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.535 ' H ' ' CG ' ' A' ' 527' ' ' ASP . 0.0 OUTLIER -142.98 -25.84 0.6 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.284 2.634 . . . . 0.0 111.153 -174.017 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.2 t-20 -82.67 -58.69 2.79 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 173.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 56.7 mt -55.87 -33.25 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.553 1.141 . . . . 0.0 108.463 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.99 -50.01 67.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.547 1.139 . . . . 0.0 112.531 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.56 -39.29 94.01 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.717 0.77 . . . . 0.0 110.17 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -68.59 -47.1 67.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.701 -0.624 . . . . 0.0 110.245 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 77.5 m -67.24 -27.27 67.08 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 112.154 175.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.509 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.6 t80 -65.03 -53.38 46.82 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 26.0 m -55.8 -44.54 77.9 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 124.44 1.096 . . . . 0.0 109.995 177.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.25 -45.88 82.78 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.9 t -64.89 -44.6 89.11 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.579 -0.7 . . . . 0.0 109.666 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 5.6 tt -56.51 -51.32 68.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.593 1.157 . . . . 0.0 109.776 174.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -61.6 -44.99 95.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.841 -178.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -64.43 -29.71 70.75 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.482 1.913 . . . . 0.0 109.872 175.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.01 -59.91 3.63 Favored 'General case' 0 C--N 1.342 0.243 0 O-C-N 120.735 -1.228 . . . . 0.0 107.787 173.199 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -59.35 -47.94 83.51 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 124.596 1.159 . . . . 0.0 110.527 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -50.16 -53.95 24.2 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 128.39 2.676 . . . . 0.0 109.479 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 16.7 t -67.3 -36.48 81.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.931 0.332 . . . . 0.0 111.588 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 479' ' ' LEU . 18.7 mt -65.93 -35.92 81.93 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 119.961 -1.712 . . . . 0.0 110.022 177.081 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 32.0 mt -71.65 -38.36 70.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.188 1.395 . . . . 0.0 110.003 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.57 -53.98 51.83 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 108.492 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 65.7 mt -56.73 -46.76 81.14 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.837 1.255 . . . . 0.0 110.223 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -63.72 -36.89 85.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 118.398 -0.81 . . . . 0.0 111.032 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.22 -52.88 63.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.03 -39.06 91.01 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.706 0.685 . . . . 0.0 109.998 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.04 -45.87 91.68 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.5 1.12 . . . . 0.0 111.014 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.321 0.4 OUTLIER -76.24 -34.25 59.2 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.222 -0.924 . . . . 0.0 110.648 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.5 mm -66.52 -34.53 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 119.612 1.096 . . . . 0.0 109.241 173.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.33 82.83 Favored 'General case' 0 CA--C 1.522 -0.102 0 O-C-N 120.424 -1.423 . . . . 0.0 109.892 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -68.64 -5.53 20.69 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.12 176.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 -50.51 11.13 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 121.206 1.821 . . . . 0.0 109.69 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -77.25 14.68 0.87 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.915 1.286 . . . . 0.0 113.916 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.521 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -143.28 -81.78 0.19 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.454 -0.779 . . . . 0.0 109.04 176.095 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.521 ' H ' HG23 ' A' ' 560' ' ' THR . 2.3 m170 -61.53 -40.88 96.26 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.079 1.351 . . . . 0.0 112.615 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 95.96 126.64 5.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.979 1.276 . . . . 0.0 111.735 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -73.64 166.01 24.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 173.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 16.3 m -103.53 166.53 10.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.61 -36.24 69.2 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.495 -173.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -76.46 -53.3 8.31 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.32 1.013 . . . . 0.0 109.348 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.43 -26.91 68.95 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.361 0.982 . . . . 0.0 113.199 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.465 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -72.85 -26.33 61.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.384 -1.447 . . . . 0.0 110.274 175.107 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.2 -27.16 28.21 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.721 1.608 . . . . 0.0 110.373 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -52.05 -41.58 62.42 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 173.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.465 HD12 ' HA ' ' A' ' 568' ' ' ARG . 4.2 mt -61.04 -37.53 82.93 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.028 -1.463 . . . . 0.0 113.806 177.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -49.68 76.89 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 121.014 1.734 . . . . 0.0 107.916 174.388 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.4 m -65.24 -44.99 86.42 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.615 0.572 . . . . 0.0 110.25 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -43.87 80.3 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.459 1.104 . . . . 0.0 110.65 175.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.91 -34.24 77.01 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 121.523 -0.736 . . . . 0.0 110.893 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.38 -37.87 77.76 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.986 0.812 . . . . 0.0 110.392 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -68.3 -32.03 71.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.263 0.483 . . . . 0.0 110.118 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.8 mt -79.65 -29.95 41.08 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.121 -0.987 . . . . 0.0 110.205 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -61.31 -9.27 4.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.542 1.137 . . . . 0.0 113.792 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 120.34 6.64 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 120.225 1.375 . . . . 0.0 108.116 173.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 116.331 -1.795 . . . . 0.0 107.966 -173.384 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 69.89 174.02 0.3 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.626 1.57 . . . . 0.0 111.253 -176.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -101.4 107.34 18.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 125.269 1.427 . . . . 0.0 107.919 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 5.2 t -84.17 55.4 3.31 Favored 'General case' 0 N--CA 1.445 -0.687 0 O-C-N 121.494 -0.754 . . . . 0.0 110.18 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 4.5 tmm? 48.57 45.93 21.12 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 123.386 1.565 . . . . 0.0 110.903 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -127.9 -48.55 1.36 Allowed 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 116.928 -1.511 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.565 HD12 ' CG2' ' A' ' 534' ' ' THR . 6.6 mm -61.15 -40.35 85.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.791 174.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.8 mt -62.31 -52.99 61.47 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 120.294 1.406 . . . . 0.0 109.907 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.593 HG23 HD13 ' A' ' 488' ' ' LEU . 73.5 mt -70.33 -55.33 14.91 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 117.787 -1.102 . . . . 0.0 110.86 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -49.22 -55.71 11.93 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.573 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -50.97 -46.68 61.34 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 117.175 -1.393 . . . . 0.0 113.412 174.846 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.3 tm? -61.95 -29.97 70.6 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 124.306 1.004 . . . . 0.0 111.345 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 22.2 t -67.81 -54.77 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 124.446 1.099 . . . . 0.0 109.126 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -74.6 -11.47 60.21 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.778 -0.576 . . . . 0.0 112.068 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.737 ' HB3' HD12 ' A' ' 464' ' ' LEU . 5.3 t-20 -142.33 78.05 17.04 Favored Pre-proline 0 N--CA 1.445 -0.71 0 CA-C-N 118.513 0.597 . . . . 0.0 110.297 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -65.57 -20.15 60.27 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 121.518 1.479 . . . . 0.0 111.206 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.55 -25.54 64.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.973 1.309 . . . . 0.0 111.509 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.737 HD12 ' HB3' ' A' ' 461' ' ' ASN . 25.9 mt -61.81 -15.09 38.9 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-N 119.285 0.948 . . . . 0.0 110.155 173.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 458' ' ' LEU . . . -61.65 -40.44 94.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.219 -0.925 . . . . 0.0 110.039 173.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 83.4 m -72.88 -17.93 61.47 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.882 -1.136 . . . . 0.0 111.348 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 3.5 mt -84.99 -27.68 26.29 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.267 1.027 . . . . 0.0 109.665 175.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -60.8 144.98 89.19 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.635 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.595 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.5 Cg_endo -69.86 168.55 21.37 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.165 1.91 . . . . 0.0 111.012 175.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -71.17 1.12 5.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.878 3.052 . . . . 0.0 114.004 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 474' ' ' LEU . 3.2 mp 72.95 58.76 0.11 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 129.396 3.079 . . . . 0.0 109.338 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.02 -37.08 29.74 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.322 -0.861 . . . . 0.0 110.938 -173.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.1 17.42 21.66 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 125.295 1.438 . . . . 0.0 112.291 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 471' ' ' LEU . 15.2 mt -106.41 -94.9 0.36 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.232 -1.366 . . . . 0.0 109.004 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 46.6 t0 78.92 142.99 0.08 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.376 2.271 . . . . 0.0 109.83 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.93 -19.37 62.59 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.135 -0.978 . . . . 0.0 109.805 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -59.92 -43.17 95.08 Favored 'General case' 0 C--N 1.341 0.212 0 O-C-N 121.078 -1.013 . . . . 0.0 110.07 174.325 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -32.58 43.97 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 118.878 -0.582 . . . . 0.0 110.42 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 482' ' ' LEU . 60.4 mt -131.9 96.2 20.85 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 125.839 1.655 . . . . 0.0 108.821 -174.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.28 1.95 3.68 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 123.428 2.752 . . . . 0.0 113.165 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -109.36 -13.53 16.95 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 120.99 -1.069 . . . . 0.0 111.838 174.044 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.656 HD23 ' O ' ' A' ' 482' ' ' LEU . 5.6 tt -61.06 -35.43 76.92 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 116.687 -1.625 . . . . 0.0 108.816 174.11 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -41.95 -46.56 5.09 Favored Glycine 0 N--CA 1.479 1.536 0 CA-C-N 119.746 1.157 . . . . 0.0 111.553 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 488' ' ' LEU . 0.2 OUTLIER -60.66 -49.12 78.8 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.581 0.752 . . . . 0.0 110.709 177.756 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -59.8 -46.11 90.24 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.243 1.017 . . . . 0.0 111.274 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -49.69 76.05 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 117.611 -1.185 . . . . 0.0 107.994 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.64 -39.65 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.996 0.918 . . . . 0.0 110.601 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.755 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.13 -54.1 50.8 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.833 1.253 . . . . 0.0 111.329 174.461 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 468' ' ' VAL . 88.8 t -60.04 -46.1 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 116.773 -1.584 . . . . 0.0 108.288 175.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -54.9 -50.06 69.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.377 1.871 . . . . 0.0 109.028 -175.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.6 m -58.0 -50.65 72.68 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.74 173.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.1 m -61.2 -36.86 81.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.685 1.584 . . . . 0.0 112.75 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -21.41 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 128.562 2.745 . . . . 0.0 110.974 173.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.32 -58.79 1.98 Allowed 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 117.658 -1.163 . . . . 0.0 108.669 173.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.596 ' HB3' HD13 ' A' ' 498' ' ' LEU . 97.2 mm-40 -46.24 93.06 0.05 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 128.345 2.658 . . . . 0.0 112.148 -173.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -73.16 119.84 6.25 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.653 2.235 . . . . 0.0 110.643 -173.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 66.32 36.99 92.44 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 495' ' ' GLN . 14.3 tp -61.7 160.94 10.76 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-O 121.216 0.531 . . . . 0.0 110.139 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.97 165.83 24.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 90.3 m -53.68 -41.64 67.1 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.381 1.473 . . . . 0.0 109.825 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.06 -40.81 11.01 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -62.74 -29.43 70.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.052 0.541 . . . . 0.0 111.552 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.09 -53.73 53.39 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.86 -37.3 71.11 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.38 0.536 . . . . 0.0 111.578 176.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.04 -40.53 87.18 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.163 -0.336 . . . . 0.0 111.085 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -66.72 -15.71 63.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.777 1.231 . . . . 0.0 111.917 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -116.87 16.23 15.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.906 1.682 . . . . 0.0 109.158 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -56.98 131.8 50.9 Favored 'General case' 0 C--N 1.34 0.172 0 O-C-N 120.465 -1.397 . . . . 0.0 108.936 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.62 74.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-O 119.683 -0.51 . . . . 0.0 112.456 173.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.805 HG22 ' H ' ' A' ' 512' ' ' ASN . 32.2 m -110.41 147.68 33.52 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.602 1.161 . . . . 0.0 108.485 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -61.09 -22.1 64.3 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 111.424 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.805 ' H ' HG22 ' A' ' 510' ' ' THR . 5.2 m-20 -92.26 -16.95 25.46 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 124.884 1.274 . . . . 0.0 109.775 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.55 68.03 Favored 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.58 -45.83 63.26 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.899 0.88 . . . . 0.0 112.589 178.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 52.9 m -66.27 -43.99 84.87 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.866 -0.521 . . . . 0.0 109.843 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.755 HD21 HD11 ' A' ' 488' ' ' LEU . 50.3 mt -61.73 -38.39 87.77 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.818 1.247 . . . . 0.0 111.808 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -71.07 -41.02 71.25 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 127.314 2.246 . . . . 0.0 109.399 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -61.38 -38.44 87.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 86.7 mt -78.55 -11.53 59.97 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.694 -0.669 . . . . 0.0 112.634 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 22.7 t -79.75 -55.69 4.82 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 119.186 0.903 . . . . 0.0 108.769 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -74.01 5.99 3.79 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.279 1.431 . . . . 0.0 113.256 176.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -61.56 126.35 27.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.628 -0.67 . . . . 0.0 110.362 -173.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -110.82 6.22 21.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.908 2.083 . . . . 0.0 109.823 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.59 -30.57 70.88 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.558 -1.339 . . . . 0.0 109.958 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.1 pt -113.31 -77.91 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 129.148 2.979 . . . . 0.0 110.824 -174.569 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.7 57.75 5.65 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.286 1.434 . . . . 0.0 111.295 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -145.84 179.47 7.43 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.519 -0.738 . . . . 0.0 110.183 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -128.48 -37.88 1.78 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.444 2.297 . . . . 0.0 110.545 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -79.32 -59.74 2.64 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.096 1.758 . . . . 0.0 108.962 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 32.1 mt -60.23 -24.77 31.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-O 117.852 -1.071 . . . . 0.0 108.253 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.6 -66.75 0.34 Allowed 'General case' 0 C--N 1.347 0.473 0 C-N-CA 125.012 1.325 . . . . 0.0 110.199 176.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -45.83 63.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.184 0.594 . . . . 0.0 110.274 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -62.65 -50.88 69.47 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.573 -176.631 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' THR . . . . . 0.565 ' CG2' HD12 ' A' ' 453' ' ' ILE . 9.7 m -61.01 -34.43 74.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 126.331 1.852 . . . . 0.0 110.867 176.566 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.452 ' CD1' HD13 ' A' ' 464' ' ' LEU . 78.9 t80 -63.1 -57.23 11.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.204 0.911 . . . . 0.0 109.593 178.049 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 43.8 m -60.0 -42.2 93.75 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.982 -1.009 . . . . 0.0 109.4 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -54.85 -47.11 74.58 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.483 1.513 . . . . 0.0 110.354 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.3 t -62.67 -56.19 19.98 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.851 1.66 . . . . 0.0 109.901 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.518 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -48.63 -57.26 6.5 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.805 177.353 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -54.76 -44.24 73.45 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 126.826 2.05 . . . . 0.0 109.801 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -60.75 -44.04 97.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.473 1.109 . . . . 0.0 111.621 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -56.97 11.65 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.453 ' CD1' HD21 ' A' ' 474' ' ' LEU . 27.1 m-85 -56.64 -48.51 77.37 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.417 0.448 . . . . 0.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -51.28 -53.98 30.45 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.328 1.851 . . . . 0.0 110.734 175.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 43.8 t -53.92 -44.42 70.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.95 -43.36 83.35 Favored 'General case' 0 C--O 1.225 -0.215 0 O-C-N 120.72 -1.238 . . . . 0.0 109.275 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.09 -48.52 78.4 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.405 1.482 . . . . 0.0 109.572 174.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.04 -54.4 42.0 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.425 1.09 . . . . 0.0 110.214 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 20.2 mt -54.7 -38.33 66.91 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 123.63 0.772 . . . . 0.0 109.558 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -65.37 -52.94 50.24 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -53.8 -51.05 64.73 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.517 1.127 . . . . 0.0 108.054 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.87 -41.1 99.26 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.027 -176.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -52.81 62.55 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 127.141 2.177 . . . . 0.0 109.863 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -58.15 -51.3 70.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.852 1.261 . . . . 0.0 108.835 -179.134 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.88 -37.31 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.729 -1.232 . . . . 0.0 110.217 175.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.25 -10.13 56.35 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 126.268 1.827 . . . . 0.0 111.057 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -96.75 9.45 41.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 116.704 -1.617 . . . . 0.0 109.642 173.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -100.57 -46.67 5.12 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.53 1.968 . . . . 0.0 111.198 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.13 -16.28 63.94 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.883 -1.136 . . . . 0.0 112.595 179.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.616 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.5 t -113.38 -105.33 0.39 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.616 ' H ' HG23 ' A' ' 560' ' ' THR . 1.2 m170 -44.15 -56.03 4.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 128.234 2.614 . . . . 0.0 113.159 -173.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 116.98 133.05 4.98 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 128.318 2.866 . . . . 0.0 108.303 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.2 mt -78.41 -171.27 2.36 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.9 m -137.19 171.83 13.9 Favored 'General case' 0 CA--C 1.498 -1.022 0 O-C-N 119.458 -2.026 . . . . 0.0 110.324 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.24 -48.18 74.31 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 113.248 -1.796 . . . . 0.0 109.05 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -72.91 -48.89 33.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.371 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -56.16 -43.34 78.26 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.147 0.579 . . . . 0.0 110.293 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -60.76 -37.57 82.3 Favored 'General case' 0 C--N 1.346 0.425 0 O-C-N 121.14 -0.975 . . . . 0.0 111.251 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.443 HD13 ' HD1' ' A' ' 572' ' ' TRP . 3.3 mm? -74.99 -33.46 61.84 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 122.836 0.455 . . . . 0.0 109.916 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -60.91 -40.71 94.2 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 120.443 -1.41 . . . . 0.0 107.586 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.7 mt -59.84 -41.98 92.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 116.654 -1.641 . . . . 0.0 110.475 173.273 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.444 ' CE3' ' HG2' ' A' ' 576' ' ' GLN . 0.0 OUTLIER -55.97 -51.41 67.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.261 1.846 . . . . 0.0 106.974 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -59.55 -38.17 80.36 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 125.554 1.784 . . . . 0.0 109.123 -173.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.18 -52.69 57.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.396 1.478 . . . . 0.0 111.46 176.074 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -61.03 -45.75 93.51 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.54 1.936 . . . . 0.0 110.804 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' GLN . . . . . 0.444 ' HG2' ' CE3' ' A' ' 572' ' ' TRP . 2.1 mp0 -67.43 -26.37 66.38 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 118.143 -0.932 . . . . 0.0 110.365 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -32.38 73.84 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.569 1.148 . . . . 0.0 110.559 173.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 6.4 mt -83.55 -29.85 27.53 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 179.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -67.45 -51.42 51.71 Favored 'General case' 0 C--N 1.365 1.249 0 CA-C-O 121.994 0.902 . . . . 0.0 110.623 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 37.42 86.41 0.01 OUTLIER 'General case' 0 C--N 1.345 0.406 0 C-N-CA 130.569 3.547 . . . . 0.0 110.381 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.4 mttt . . . . . 0 N--CA 1.47 0.539 0 O-C-N 120.158 -1.589 . . . . 0.0 110.183 -173.141 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.721 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -55.96 -79.16 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' THR . . . . . 0.723 HG21 ' HA ' ' A' ' 538' ' ' SER . 2.6 t -159.97 165.16 32.55 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 105.807 -1.924 . . . . 0.0 105.807 173.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 11.7 m -138.54 159.37 42.25 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.6 ptt? -53.04 -26.66 16.52 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 120.06 1.3 . . . . 0.0 112.842 174.746 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -61.29 -31.95 71.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.39 -2.243 . . . . 0.0 111.662 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 13.1 mm -63.23 -52.41 58.99 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 121.124 1.783 . . . . 0.0 108.791 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 10.7 mt -53.13 -50.38 64.62 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.522 1.055 . . . . 0.0 110.432 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.623 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 mt -59.0 -59.71 3.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.329 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.82 99.45 Favored Glycine 0 C--O 1.223 -0.535 0 CA-C-N 119.939 1.245 . . . . 0.0 112.54 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 525' ' ' ILE . 1.0 OUTLIER -61.48 -43.51 98.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.565 -0.962 . . . . 0.0 108.619 177.095 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.511 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.1 tm? -65.79 -35.75 81.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.947 1.299 . . . . 0.0 111.373 175.1 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 455' ' ' ILE . 75.2 t -59.9 -56.3 18.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 O-C-N 120.994 -1.066 . . . . 0.0 108.3 174.137 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 460' ' ' GLN . . . . . 0.518 ' OE1' HG12 ' A' ' 459' ' ' VAL . 2.2 mp0 -75.39 -9.92 58.99 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.981 -0.45 . . . . 0.0 111.944 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 6.9 t-20 -147.14 73.25 12.08 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 125.125 1.37 . . . . 0.0 109.894 -177.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.74 -19.99 59.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.782 2.321 . . . . 0.0 112.668 -174.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.29 -21.82 64.29 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.978 1.711 . . . . 0.0 110.153 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.425 HD13 ' CD1' ' A' ' 535' ' ' PHE . 76.5 mt -63.82 -13.51 45.1 Favored 'General case' 0 C--N 1.351 0.644 0 O-C-N 120.441 -1.412 . . . . 0.0 110.513 173.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.38 -32.64 74.37 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.122 0.874 . . . . 0.0 110.243 173.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.1 m -77.75 -17.35 57.64 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.783 -1.198 . . . . 0.0 110.943 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.79 -11.92 38.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 117.605 -1.188 . . . . 0.0 112.244 174.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 469' ' ' PRO . 2.4 p -94.5 151.28 39.18 Favored Pre-proline 0 CA--C 1.542 0.671 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.549 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.7 Cg_endo -72.77 177.72 7.26 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.42 2.747 . . . . 0.0 112.519 175.574 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.9 5.22 3.58 Favored 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.421 2.747 . . . . 0.0 114.643 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 474' ' ' LEU 0.254 1.8 mm? 71.18 47.81 0.39 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 129.342 3.057 . . . . 0.0 114.291 179.525 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -87.95 -20.09 26.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -173.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -106.05 -3.08 22.0 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.448 -1.407 . . . . 0.0 111.895 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.654 HD21 ' CE1' ' A' ' 543' ' ' PHE . 3.5 mp -109.1 -78.53 0.59 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 125.511 1.525 . . . . 0.0 108.508 -173.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 11.0 t70 62.61 162.73 0.09 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.121 1.768 . . . . 0.0 110.987 -173.274 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.8 -21.79 60.93 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.429 -1.419 . . . . 0.0 108.755 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -51.74 -43.29 62.84 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.159 2.584 . . . . 0.0 110.032 173.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -84.09 -49.7 8.65 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.477 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 13.0 mt -114.28 102.22 54.67 Favored Pre-proline 0 N--CA 1.47 0.556 0 C-N-CA 123.588 0.755 . . . . 0.0 112.034 -173.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.21 -26.03 15.18 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.56 2.174 . . . . 0.0 111.422 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -85.91 -15.98 64.19 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.646 -1.086 . . . . 0.0 112.656 174.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -25.55 65.22 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 119.021 1.41 . . . . 0.0 108.806 173.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.66 -48.35 7.38 Favored Glycine 0 C--O 1.218 -0.895 0 CA-C-N 119.85 1.205 . . . . 0.0 111.146 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -46.81 87.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.154 0.977 . . . . 0.0 110.677 176.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -59.74 -49.37 78.01 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.596 -0.69 . . . . 0.0 110.846 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -64.66 -44.85 89.1 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 124.881 1.272 . . . . 0.0 110.028 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.37 -49.45 76.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.753 1.221 . . . . 0.0 108.131 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.15 -51.33 70.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.342 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.49 HG11 ' CG1' ' A' ' 468' ' ' VAL . 38.6 t -56.69 -46.79 83.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 124.656 1.182 . . . . 0.0 109.935 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -58.32 -46.76 85.57 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.019 1.327 . . . . 0.0 108.587 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' THR . . . . . 0.409 HG21 ' HE1' ' A' ' 507' ' ' TYR . 18.1 m -64.53 -39.68 94.21 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 124.188 0.995 . . . . 0.0 110.364 173.388 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.511 ' SG ' HD11 ' A' ' 458' ' ' LEU . 81.1 m -62.99 -41.96 99.71 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 120.777 1.626 . . . . 0.0 110.775 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.57 -22.84 67.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.667 1.587 . . . . 0.0 111.355 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.1 t -85.25 -50.44 7.36 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.752 0.821 . . . . 0.0 110.206 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -67.6 104.44 0.66 Allowed Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.3 1.84 . . . . 0.0 110.424 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -68.09 122.55 9.64 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.097 1.865 . . . . 0.0 110.018 -174.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.12 40.4 99.14 Favored Glycine 0 C--N 1.34 0.764 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 503' ' ' LEU . 34.8 tp -57.35 155.64 8.82 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.255 1.026 . . . . 0.0 110.662 175.552 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 2.4 p -143.0 163.36 32.99 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 37.4 m -50.41 -48.58 56.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.653 1.981 . . . . 0.0 110.431 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.6 17.36 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -59.89 -24.41 64.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.757 1.223 . . . . 0.0 111.569 176.322 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 498' ' ' LEU . 9.7 tp -61.66 -49.45 76.47 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 119.666 1.121 . . . . 0.0 110.097 175.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 517' ' ' GLU . 3.1 mp -64.25 -33.58 76.13 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.883 -0.579 . . . . 0.0 111.818 176.31 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -68.87 -45.78 70.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.734 0.814 . . . . 0.0 108.836 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -63.59 -17.17 62.58 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.952 -1.093 . . . . 0.0 113.04 174.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.5 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 20.5 m-85 -110.81 13.6 22.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.315 1.446 . . . . 0.0 109.1 177.362 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -56.19 129.45 40.22 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 119.576 -1.952 . . . . 0.0 109.133 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 78.64 8.2 87.79 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 118.979 -0.901 . . . . 0.0 113.967 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.787 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -92.5 146.85 23.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.058 1.429 . . . . 0.0 108.412 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -19.64 54.76 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 121.174 -0.954 . . . . 0.0 111.043 176.207 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.787 ' H ' HG22 ' A' ' 510' ' ' THR . 1.6 m-20 -94.22 -18.68 21.45 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.492 1.917 . . . . 0.0 111.508 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -49.96 -40.75 44.81 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.538 1.135 . . . . 0.0 110.608 176.134 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.61 66.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.461 2.304 . . . . 0.0 110.081 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' THR . . . . . 0.545 HG22 HD11 ' A' ' 519' ' ' LEU . 6.8 m -58.51 -54.16 50.21 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 117.061 -1.447 . . . . 0.0 107.285 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 516' ' ' LEU . 2.6 mm? -53.95 -42.49 68.93 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.76 1.164 . . . . 0.0 110.878 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.605 ' HA ' HD21 ' A' ' 504' ' ' LEU . 6.3 tt0 -62.58 -46.71 87.1 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.304 1.842 . . . . 0.0 111.405 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -32.51 72.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.471 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.545 HD11 HG22 ' A' ' 515' ' ' THR . 31.4 mt -76.44 -22.74 54.24 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.169 174.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.1 t -65.17 -58.8 5.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 121.334 1.879 . . . . 0.0 111.824 -178.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.99 1.38 5.73 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.479 1.511 . . . . 0.0 113.517 175.065 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.53 ' CE3' HD11 ' A' ' 525' ' ' ILE . 2.7 t90 -71.46 86.15 0.85 Allowed 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.428 1.091 . . . . 0.0 109.591 -173.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.19 -12.7 19.36 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.719 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.63 -13.65 0.7 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 128.028 2.531 . . . . 0.0 114.159 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.702 HD13 ' CD2' ' A' ' 457' ' ' LEU . 4.3 mt -57.61 -78.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 C-N-CA 128.406 2.682 . . . . 0.0 111.685 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -171.28 -86.7 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 124.166 1.936 . . . . 0.0 114.165 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -157.84 158.15 34.61 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 127.048 2.139 . . . . 0.0 111.649 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -27.54 69.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 119.175 0.898 . . . . 0.0 112.746 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -71.36 -50.97 26.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.077 1.308 . . . . 0.0 109.416 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 10.5 mt -74.46 -4.17 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.584 1.554 . . . . 0.0 109.857 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.03 -63.35 1.33 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.553 1.07 . . . . 0.0 108.715 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -51.62 -43.75 62.68 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 122.7 0.4 . . . . 0.0 110.215 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -54.06 51.26 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.568 0.747 . . . . 0.0 111.399 175.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 57.8 m -57.23 -35.74 70.05 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.512 1.125 . . . . 0.0 110.641 176.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.425 ' CD1' HD13 ' A' ' 464' ' ' LEU . 87.5 t80 -67.12 -57.9 5.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.095 0.862 . . . . 0.0 111.077 177.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.8 m -54.69 -45.03 73.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.069 -0.967 . . . . 0.0 109.183 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -62.0 -38.85 90.18 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.315 0.961 . . . . 0.0 110.575 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.723 ' HA ' HG21 ' A' ' 449' ' ' THR . 1.6 t -62.98 -56.98 12.36 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.081 1.352 . . . . 0.0 110.672 174.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -49.09 -48.22 44.49 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.678 1.191 . . . . 0.0 108.19 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -57.9 -49.62 76.11 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -61.57 -35.27 77.32 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.777 1.231 . . . . 0.0 113.033 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.23 28.65 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 173.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.654 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.9 m-85 -59.89 -43.14 94.95 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.285 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.4 -51.64 66.17 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 110.206 174.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 14.8 t -52.08 -49.31 63.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.295 1.038 . . . . 0.0 110.194 173.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 474' ' ' LEU . 33.0 mt -67.13 -39.67 86.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.652 -174.273 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.63 -43.67 88.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 126.307 1.843 . . . . 0.0 109.696 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.06 -51.47 69.05 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 126.245 1.818 . . . . 0.0 109.298 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 4.5 mt -55.26 -51.6 66.11 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.74 1.216 . . . . 0.0 108.994 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.9 ttm-85 -58.82 -53.39 58.95 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.709 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -48.85 -51.81 27.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.827 1.251 . . . . 0.0 109.403 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.04 -38.53 82.63 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.467 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -50.83 70.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.106 1.762 . . . . 0.0 108.939 176.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.634 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.5 mt -57.9 -53.31 59.65 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.973 1.709 . . . . 0.0 108.96 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.5 -35.44 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 121.134 1.788 . . . . 0.0 109.985 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.17 -24.78 67.8 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.658 -1.276 . . . . 0.0 110.754 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -96.5 -1.54 47.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 116.179 -1.867 . . . . 0.0 109.773 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -43.11 14.2 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 122.974 2.625 . . . . 0.0 111.119 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -72.05 -3.76 24.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.601 2.36 . . . . 0.0 115.034 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.531 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -138.63 -89.31 0.22 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -176.911 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.531 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -48.49 -41.46 29.94 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.21 1.804 . . . . 0.0 112.054 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 72.36 80.04 0.42 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 109.08 -1.608 . . . . 0.0 109.08 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.45 158.27 0.29 Allowed 'General case' 0 C--O 1.238 0.487 0 O-C-N 124.937 1.022 . . . . 0.0 109.823 172.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.84 160.87 25.11 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.036 0.922 . . . . 0.0 110.489 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -37.84 74.22 Favored 'General case' 0 N--CA 1.458 -0.035 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.792 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.87 -53.34 57.08 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 125.717 1.607 . . . . 0.0 110.189 175.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -40.92 73.15 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.293 1.406 . . . . 0.0 112.457 174.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.46 ' HA ' HD12 ' A' ' 571' ' ' LEU . 20.3 ttm180 -63.1 -37.36 86.9 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.381 -1.45 . . . . 0.0 110.158 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.415 HD23 ' HD1' ' A' ' 572' ' ' TRP . 4.8 mt -71.13 -38.84 72.28 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.042 -1.456 . . . . 0.0 108.958 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -50.91 -44.12 59.96 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.424 1.011 . . . . 0.0 109.361 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.634 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.4 mt -56.58 -41.34 76.78 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 117.053 -1.451 . . . . 0.0 114.331 173.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.415 ' HD1' HD23 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -62.94 -45.66 91.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 121.982 2.174 . . . . 0.0 107.085 179.482 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -54.11 49.88 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -41.77 66.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.038 1.735 . . . . 0.0 111.825 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.22 -39.7 89.78 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.55 -1.344 . . . . 0.0 109.885 -177.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -74.7 -21.42 59.4 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.152 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -81.15 -34.63 32.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.485 1.514 . . . . 0.0 111.359 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.47 -27.3 37.87 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.959 1.304 . . . . 0.0 111.464 174.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 48.94 67.97 0.78 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 126.237 1.815 . . . . 0.0 111.373 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -102.15 154.05 19.37 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.637 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 C--O 1.238 0.494 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 173.305 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 12.8 mttt . . . . . 0 N--CA 1.462 0.152 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.613 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.52 177.65 0.57 Allowed 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 127.612 2.365 . . . . 0.0 106.505 -177.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 449' ' ' THR . . . . . 0.414 HG21 ' HA ' ' A' ' 538' ' ' SER . 77.1 m 64.02 112.68 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 O-C-N 126.048 2.092 . . . . 0.0 109.224 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 24.5 m -135.27 162.04 33.68 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 119.997 -1.69 . . . . 0.0 107.731 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -28.84 9.89 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.636 1.574 . . . . 0.0 112.963 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -42.53 78.27 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 116.1 -1.905 . . . . 0.0 109.246 173.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.6 mm -58.24 -52.88 53.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.2 mt -50.88 -47.67 60.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 120.2 1.363 . . . . 0.0 110.264 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.571 HG23 HD13 ' A' ' 488' ' ' LEU . 56.5 mt -62.35 -58.07 9.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 124.969 1.307 . . . . 0.0 110.765 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -58.81 -37.52 90.51 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.885 2.183 . . . . 0.0 112.022 -177.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 81.1 mt -65.89 -41.95 90.9 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 117.523 -1.227 . . . . 0.0 108.838 173.587 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -30.3 68.19 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 120.202 1.365 . . . . 0.0 111.375 175.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.582 ' HA ' HD22 ' A' ' 503' ' ' LEU . 17.4 t -64.11 -54.8 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 124.582 1.153 . . . . 0.0 109.239 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -80.16 -10.12 59.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.916 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.61 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.5 t-20 -138.17 74.11 43.17 Favored Pre-proline 0 N--CA 1.448 -0.528 0 C-N-CA 123.371 0.668 . . . . 0.0 110.783 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.8 Cg_endo -65.55 -18.45 59.36 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.881 1.721 . . . . 0.0 112.066 -177.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.23 -20.68 61.51 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 123.839 0.856 . . . . 0.0 110.329 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.61 HD12 ' HB3' ' A' ' 461' ' ' ASN . 27.3 mt -62.68 -12.81 25.87 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.926 1.694 . . . . 0.0 110.029 176.593 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.87 74.54 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.015 0.926 . . . . 0.0 111.13 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 51.6 m -78.59 -17.04 56.69 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.685 1.13 . . . . 0.0 111.262 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.52 -23.37 22.06 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.753 1.221 . . . . 0.0 110.821 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.781 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -78.54 150.78 76.79 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 118.54 0.609 . . . . 0.0 109.464 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.781 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.6 Cg_endo -75.56 168.31 24.7 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.435 2.09 . . . . 0.0 112.124 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.49 3.87 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.703 3.602 . . . . 0.0 113.647 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 486' ' ' ARG . 3.2 mp 68.54 63.47 0.34 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.604 1.962 . . . . 0.0 110.739 176.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -89.74 -38.98 13.45 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.779 0.8 . . . . 0.0 111.138 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -108.39 0.56 21.19 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.452 2.701 . . . . 0.0 110.808 -176.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.58 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.7 mm? -84.16 -91.15 0.09 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.247 -2.872 . . . . 0.0 103.247 -177.199 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 41.6 t0 65.02 150.36 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.764 1.626 . . . . 0.0 110.72 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' GLU . . . . . 0.419 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 12.2 mt-10 -78.63 -17.97 55.21 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 120.147 -1.596 . . . . 0.0 109.072 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.33 -31.47 70.32 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.195 1.398 . . . . 0.0 111.216 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -94.93 -27.43 15.68 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.748 175.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 546' ' ' LEU . 3.0 mm? -125.06 89.01 53.34 Favored Pre-proline 0 C--O 1.237 0.433 0 CA-C-N 119.321 0.964 . . . . 0.0 110.801 -176.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.96 76.51 0.83 Allowed 'Trans proline' 0 CA--C 1.541 0.865 1 C-N-CA 125.962 4.442 . . . . 0.0 110.378 -175.175 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 144.7 -19.09 2.01 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.884 1.707 . . . . 0.0 113.905 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.94 -25.12 66.57 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 116.973 -1.489 . . . . 0.0 109.543 173.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' GLY . . . . . 0.419 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -44.22 -42.32 6.82 Favored Glycine 0 C--O 1.217 -0.928 0 CA-C-N 120.449 1.477 . . . . 0.0 110.763 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.519 HD23 HD13 ' A' ' 455' ' ' ILE . 33.1 tp -58.17 -51.09 71.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.554 1.177 . . . . 0.0 112.643 176.263 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.416 ' O ' HG23 ' A' ' 489' ' ' VAL . 80.0 t80 -58.2 -52.46 65.49 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 126.303 1.841 . . . . 0.0 110.79 173.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.571 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.1 OUTLIER -53.35 -51.58 62.01 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.671 1.588 . . . . 0.0 108.58 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.39 -42.42 83.37 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.23 1.412 . . . . 0.0 109.974 -176.705 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.571 HD13 HG23 ' A' ' 455' ' ' ILE . 0.2 OUTLIER -57.78 -48.69 78.95 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 124.481 1.112 . . . . 0.0 110.615 177.131 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 468' ' ' VAL . 84.5 t -63.62 -48.12 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 117.756 -1.116 . . . . 0.0 108.356 175.837 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -52.34 -41.65 63.21 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.117 1.326 . . . . 0.0 109.77 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.9 m -72.01 -42.16 66.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 126.513 1.925 . . . . 0.0 112.019 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.7 m -62.56 -39.77 94.73 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.199 1.363 . . . . 0.0 110.549 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -24.26 67.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.914 1.686 . . . . 0.0 111.975 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.58 -56.71 4.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.518 1.527 . . . . 0.0 107.997 174.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.9 100.0 0.23 Allowed Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 124.353 1.061 . . . . 0.0 111.267 -173.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.28 138.25 75.92 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 N-CA-C 107.274 -1.856 . . . . 0.0 107.274 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 55.93 36.61 67.36 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 124.528 1.061 . . . . 0.0 112.833 173.692 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 462' ' ' PRO . 7.2 tp -64.28 151.62 43.25 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.78 163.81 19.51 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.309 2.243 . . . . 0.0 107.665 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 91.6 m -58.57 -44.03 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.208 1.003 . . . . 0.0 111.18 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.46 -34.04 60.73 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -67.38 -29.0 68.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.616 1.208 . . . . 0.0 111.531 -177.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.582 HD22 ' HA ' ' A' ' 459' ' ' VAL . 13.8 tp -58.87 -51.96 67.78 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.121 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.65 -30.22 67.15 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.454 0.702 . . . . 0.0 111.569 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -71.86 -43.73 64.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.11 0.868 . . . . 0.0 112.468 176.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -63.86 -18.28 64.0 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.078 1.751 . . . . 0.0 111.859 173.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.521 ' CD2' HD13 ' A' ' 516' ' ' LEU . 69.1 m-85 -117.58 17.71 14.39 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.697 1.999 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -62.03 -19.22 62.65 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 121.357 1.89 . . . . 0.0 114.158 -176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -136.06 42.26 1.34 Allowed Glycine 0 C--O 1.227 -0.311 0 C-N-CA 124.996 1.284 . . . . 0.0 110.852 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.707 HG22 ' H ' ' A' ' 512' ' ' ASN . 48.7 m -108.09 145.99 33.26 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -21.35 65.39 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 121.217 -0.927 . . . . 0.0 112.011 174.524 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.707 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m-20 -88.95 -26.28 21.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 130.817 3.647 . . . . 0.0 109.675 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -40.49 -43.89 1.93 Allowed 'General case' 0 C--O 1.206 -1.203 0 C-N-CA 124.24 1.016 . . . . 0.0 110.426 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.77 -52.63 47.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.876 1.67 . . . . 0.0 113.217 176.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 89.7 m -63.73 -45.21 90.91 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 124.842 1.257 . . . . 0.0 109.693 174.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.521 HD13 ' CD2' ' A' ' 507' ' ' TYR . 42.9 mt -60.52 -34.52 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.292 1.037 . . . . 0.0 111.21 177.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -40.77 64.46 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 127.04 2.136 . . . . 0.0 109.412 -178.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -64.55 -37.94 89.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.497 HD22 ' CE3' ' A' ' 522' ' ' TRP . 88.0 mt -77.32 -10.9 59.72 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 118.395 -0.812 . . . . 0.0 112.515 173.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 9.4 t -69.92 -66.04 0.64 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.192 1.397 . . . . 0.0 108.388 177.786 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.38 14.36 2.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.459 1.904 . . . . 0.0 111.742 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.678 ' CE3' HD11 ' A' ' 525' ' ' ILE . 4.4 t90 -53.69 123.97 13.8 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -28.62 15.55 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.281 -173.583 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -49.75 -30.26 9.12 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 125.502 1.521 . . . . 0.0 111.031 -177.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.678 HD11 ' CE3' ' A' ' 522' ' ' TRP . 1.6 pt -110.27 -70.84 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 130.834 3.654 . . . . 0.0 112.457 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.38 52.09 3.67 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 126.877 2.071 . . . . 0.0 112.311 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 527' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 531' ' ' ALA . 3.3 t70 -151.11 150.21 30.41 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.61 -174.138 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -106.88 -27.71 10.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.364 1.066 . . . . 0.0 111.983 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -87.66 -60.75 1.89 Allowed 'General case' 0 CA--C 1.51 -0.584 0 C-N-CA 124.567 1.147 . . . . 0.0 108.936 -177.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 45.0 mt -55.55 -28.12 22.35 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 527' ' ' ASP . . . -50.69 -60.32 3.16 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.814 1.246 . . . . 0.0 111.206 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -52.74 -42.97 65.41 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 119.058 0.844 . . . . 0.0 110.602 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -49.48 69.64 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.31 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 61.2 m -58.94 -31.37 68.63 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.156 1.782 . . . . 0.0 107.75 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.524 ' CD1' HD13 ' A' ' 464' ' ' LEU . 39.4 t80 -66.55 -58.05 6.0 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 109.551 178.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 80.6 m -63.23 -39.6 95.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.706 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -60.02 -45.18 93.62 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.467 1.107 . . . . 0.0 108.361 175.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.414 ' HA ' HG21 ' A' ' 449' ' ' THR . 14.7 t -70.4 -51.77 27.23 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.479 -1.388 . . . . 0.0 112.002 -176.26 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.3 tt -46.8 -49.94 19.13 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 126.708 2.003 . . . . 0.0 111.083 170.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.267 0.9 OUTLIER -65.68 -33.56 76.18 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-O 116.04 -1.933 . . . . 0.0 110.342 179.071 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -72.04 -35.45 69.35 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.049 1.295 . . . . 0.0 110.36 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -57.72 9.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.58 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.5 m-85 -58.76 -42.38 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 126.487 1.915 . . . . 0.0 111.343 -177.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.68 -49.14 78.66 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 127.551 2.341 . . . . 0.0 109.096 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.6 t -56.59 -35.62 68.44 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.626 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 479' ' ' LEU . 16.2 mt -74.0 -40.82 62.67 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.712 1.205 . . . . 0.0 111.087 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 30.8 mt -61.7 -44.86 96.13 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 117.517 -1.23 . . . . 0.0 109.0 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.046 0.938 . . . . 0.0 111.476 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 549' ' ' LEU . . . . . 0.564 HD23 ' N ' ' A' ' 550' ' ' ARG . 0.2 OUTLIER -54.33 -45.55 72.69 Favored 'General case' 0 CA--C 1.451 -2.85 0 C-N-CA 124.493 1.117 . . . . 0.0 111.346 173.704 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 550' ' ' ARG . . . . . 0.564 ' N ' HD23 ' A' ' 549' ' ' LEU . 1.3 ttm-85 -63.98 -51.07 66.01 Favored 'General case' 0 C--N 1.272 -2.777 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.69 -51.95 52.04 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.654 1.182 . . . . 0.0 109.149 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.89 -43.24 99.26 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.063 -176.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -40.21 95.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.196 1.798 . . . . 0.0 110.373 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 571' ' ' LEU . 4.2 mt -60.72 -55.13 36.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.697 1.199 . . . . 0.0 107.835 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.9 mm -61.57 -39.54 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 120.255 1.389 . . . . 0.0 111.763 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -60.25 -18.29 47.87 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.503 1.521 . . . . 0.0 109.542 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.18 18.49 12.19 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 120.577 1.535 . . . . 0.0 111.39 173.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.85 -63.83 1.4 Allowed 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 121.164 1.802 . . . . 0.0 109.523 177.321 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -8.8 53.51 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.181 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.05 -43.01 3.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.358 1.435 . . . . 0.0 109.886 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -115.06 -74.18 0.62 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.495 1.518 . . . . 0.0 109.09 -173.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 148.62 109.18 0.52 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -79.78 132.74 36.22 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.3 t -66.57 165.32 14.86 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.88 -39.9 86.87 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.759 . . . . 0.0 110.624 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.73 -51.56 26.56 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 123.995 0.918 . . . . 0.0 109.343 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -59.0 -30.4 67.96 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 123.793 1.759 . . . . 0.0 111.526 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.97 -38.37 72.78 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 118.785 -2.447 . . . . 0.0 106.147 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 18.4 mt -67.76 -32.9 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.487 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.5 -43.55 62.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.131 1.332 . . . . 0.0 108.912 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.0 OUTLIER -61.78 -39.84 93.1 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 117.423 -1.275 . . . . 0.0 112.803 177.205 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -50.48 72.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.166 1.803 . . . . 0.0 108.172 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -35.91 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 124.146 0.904 . . . . 0.0 109.404 -175.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -52.61 37.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.789 1.636 . . . . 0.0 110.95 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -57.4 -46.22 83.7 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.464 1.906 . . . . 0.0 111.468 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.8 -24.72 65.33 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 111.66 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.21 -33.89 43.36 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 119.257 0.935 . . . . 0.0 109.346 173.757 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.83 -25.49 44.12 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 128.024 2.53 . . . . 0.0 109.869 -176.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -53.56 -48.1 69.43 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.776 1.23 . . . . 0.0 111.73 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.45 -59.86 0.27 Allowed 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.306 175.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.628 0 CA-C-O 114.231 -2.795 . . . . 0.0 104.569 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.436 ' HE2' ' NE2' ' A' ' 541' ' ' HIS . 3.4 tmtm? . . . . . 0 C--O 1.238 0.499 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 47.9 ttt180 -77.96 69.84 4.25 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.1 m -143.4 148.92 36.92 Favored 'General case' 0 N--CA 1.434 -1.26 0 C-N-CA 125.307 1.443 . . . . 0.0 108.139 -173.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.45 -91.86 0.55 Allowed 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 46.5 ttm -164.53 -40.39 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.386 1.075 . . . . 0.0 109.024 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -56.02 -19.23 11.85 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.26 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.4 mm -51.99 -52.14 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 125.167 1.387 . . . . 0.0 109.409 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.54 -42.71 67.76 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.494 0.588 . . . . 0.0 111.517 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.527 HG23 HD22 ' A' ' 488' ' ' LEU . 43.8 mt -69.39 -53.08 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.227 0.611 . . . . 0.0 109.553 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -64.18 -43.43 97.12 Favored Glycine 0 C--N 1.336 0.534 0 CA-C-N 118.749 0.704 . . . . 0.0 112.679 -173.898 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.22 -41.68 96.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.154 177.353 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.411 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.4 tm? -64.77 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.83 0.741 . . . . 0.0 110.68 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.63 -50.96 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 121.599 -0.688 . . . . 0.0 109.541 173.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -72.59 -28.63 62.91 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.293 -174.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -133.55 84.47 45.61 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 126.895 2.078 . . . . 0.0 111.643 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -65.36 -21.48 61.03 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 121.945 1.763 . . . . 0.0 113.3 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.64 -17.02 62.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.069 0.849 . . . . 0.0 111.278 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.41 -15.58 58.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.207 -0.933 . . . . 0.0 110.673 173.77 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.77 -25.47 67.27 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 119.452 1.024 . . . . 0.0 111.047 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 7.9 m -83.41 -12.82 56.01 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.066 0.946 . . . . 0.0 110.789 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 20.8 mt -103.17 -7.55 21.15 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 112.478 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -92.32 137.89 24.5 Favored Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 119.995 1.27 . . . . 0.0 109.692 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.05 164.72 24.0 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.17 2.58 . . . . 0.0 110.355 173.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.72 16.57 0.27 Allowed 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 123.474 2.783 . . . . 0.0 115.515 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.543 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.5 mm? 69.38 16.4 8.3 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 128.367 2.667 . . . . 0.0 113.249 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -57.79 -20.26 34.11 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.129 2.572 . . . . 0.0 115.396 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.3 10.08 19.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.34 1.456 . . . . 0.0 111.826 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.1 mp -124.13 -58.21 1.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.047 0.939 . . . . 0.0 111.731 -173.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 25.8 t0 64.59 157.25 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.533 1.533 . . . . 0.0 108.866 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -75.27 -21.96 58.14 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 119.711 -1.868 . . . . 0.0 107.576 173.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -61.8 -49.21 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.291 2.237 . . . . 0.0 113.202 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 48.0 mmtt -77.21 -20.31 55.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.715 -0.659 . . . . 0.0 112.497 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -120.78 88.29 43.69 Favored Pre-proline 0 N--CA 1.453 -0.282 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.53 87.95 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.99 2.46 . . . . 0.0 111.307 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.46 -19.02 2.82 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.276 1.893 . . . . 0.0 112.589 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 8.7 tt -62.77 -25.1 68.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.822 1.311 . . . . 0.0 111.499 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.66 -40.06 17.12 Favored Glycine 0 CA--C 1.527 0.822 0 CA-C-N 118.607 0.64 . . . . 0.0 112.054 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 18.1 tp -63.89 -40.91 97.62 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.735 1.267 . . . . 0.0 112.696 174.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -61.86 -42.59 99.23 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.716 -1.24 . . . . 0.0 109.074 174.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -61.91 -47.56 84.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.294 1.038 . . . . 0.0 110.76 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.23 -56.44 14.67 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 127.238 2.215 . . . . 0.0 109.473 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 455' ' ' ILE . 2.8 mp -56.25 -59.68 4.59 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.586 1.155 . . . . 0.0 109.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 468' ' ' VAL . 72.6 t -54.68 -42.86 63.38 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.164 0 C-N-CA 123.361 0.664 . . . . 0.0 109.628 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -59.64 -44.8 93.36 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 119.131 0.878 . . . . 0.0 110.798 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.5 m -63.76 -41.61 97.96 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 123.503 0.721 . . . . 0.0 109.898 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 458' ' ' LEU . 88.5 m -62.97 -44.49 95.91 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 119.002 0.819 . . . . 0.0 110.074 -177.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -18.46 47.05 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.748 1.219 . . . . 0.0 112.817 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.8 t -99.46 -11.84 20.73 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.901 1.68 . . . . 0.0 113.023 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -106.29 90.69 4.95 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 125.234 1.414 . . . . 0.0 109.791 -176.644 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.23 122.7 10.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.845 1.697 . . . . 0.0 110.082 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 75.41 30.45 58.48 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 119.481 -0.622 . . . . 0.0 112.406 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 37.9 tp -56.07 153.3 9.18 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.81 0.805 . . . . 0.0 110.065 174.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -136.29 166.61 23.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.4 m -47.02 -49.99 20.15 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.098 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.32 -33.46 19.98 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -64.63 -27.19 68.77 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.373 0.669 . . . . 0.0 110.356 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.5 -48.65 74.38 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.358 0.663 . . . . 0.0 109.999 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.7 mp -62.67 -31.11 71.94 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.969 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -68.62 -48.84 63.07 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.693 0.679 . . . . 0.0 109.711 173.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -65.83 -20.66 66.32 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.688 -0.632 . . . . 0.0 112.349 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -107.11 8.81 30.39 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.977 0.911 . . . . 0.0 110.773 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.24 -14.88 12.43 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -173.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -118.54 12.29 12.27 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.722 1.153 . . . . 0.0 113.67 174.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.795 HG22 ' H ' ' A' ' 512' ' ' ASN . 90.8 m -94.06 146.97 23.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 119.849 1.825 . . . . 0.0 110.652 -174.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -9.87 9.8 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.396 1.078 . . . . 0.0 112.7 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.795 ' H ' HG22 ' A' ' 510' ' ' THR . 0.1 OUTLIER -94.82 -16.51 22.89 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.962 2.105 . . . . 0.0 112.201 177.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.45 -48.06 7.15 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.626 1.17 . . . . 0.0 113.232 -175.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.08 -43.92 87.29 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.311 0.505 . . . . 0.0 111.876 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.3 m -66.87 -37.91 85.32 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.722 -0.611 . . . . 0.0 110.726 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.37 -45.33 73.09 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.29 1.036 . . . . 0.0 110.965 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.24 -44.76 95.82 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -60.98 -35.39 76.68 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.857 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 39.8 mt -74.94 -27.14 60.07 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.412 1.46 . . . . 0.0 112.832 175.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 1.2 t -62.64 -47.23 84.63 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.86 12.99 11.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.635 1.574 . . . . 0.0 114.188 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -65.91 125.45 25.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.851 0.834 . . . . 0.0 111.732 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -81.44 -25.17 36.35 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 130.979 3.712 . . . . 0.0 114.308 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.64 -20.15 65.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.544 0.737 . . . . 0.0 112.331 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 4.9 pt -125.76 -64.62 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.268 1.027 . . . . 0.0 110.692 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 50.38 3.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 129.823 3.249 . . . . 0.0 118.179 174.459 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -114.92 164.84 13.57 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.724 1.147 . . . . 0.0 110.798 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.2 pttt -118.3 -13.43 9.84 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.942 1.697 . . . . 0.0 113.097 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.67 -53.56 4.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 120.44 1.473 . . . . 0.0 108.394 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.11 -24.39 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.149 1.779 . . . . 0.0 109.213 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.54 -45.34 66.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.455 1.102 . . . . 0.0 112.316 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -63.06 -51.6 66.03 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.364 0.984 . . . . 0.0 109.155 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -55.19 -44.76 75.59 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.378 0.671 . . . . 0.0 110.469 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.6 m -71.58 -29.69 65.0 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.652 0.781 . . . . 0.0 111.423 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -69.04 -51.42 39.21 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.69 1.132 . . . . 0.0 108.09 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 82.6 m -54.17 -45.45 72.09 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.305 1.042 . . . . 0.0 109.39 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -62.79 -47.72 82.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.043 0.838 . . . . 0.0 110.813 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -43.73 79.82 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.94 -52.52 62.71 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.991 0.917 . . . . 0.0 108.574 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -58.55 -45.11 89.63 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.963 0.905 . . . . 0.0 110.681 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' HIS . . . . . 0.436 ' NE2' ' HE2' ' A' ' 447' ' ' LYS . 7.3 t60 -69.42 -35.04 75.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 119.414 1.006 . . . . 0.0 110.688 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -56.05 24.71 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 173.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 10.7 m-85 -61.97 -48.34 80.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.931 0.893 . . . . 0.0 110.474 -176.14 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -55.67 -42.13 74.68 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.035 2.134 . . . . 0.0 111.787 176.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.8 t -67.08 -39.49 86.83 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.49 0.716 . . . . 0.0 111.764 174.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 41.8 mt -68.23 -38.37 81.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.434 -0.791 . . . . 0.0 109.908 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -46.35 88.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 109.001 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -64.2 -43.25 95.61 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.405 0.682 . . . . 0.0 111.131 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.84 -49.22 77.14 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.948 -1.095 . . . . 0.0 111.203 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 38.4 ttt-85 -57.8 -40.41 79.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 124.456 1.102 . . . . 0.0 109.668 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -56.09 -49.21 74.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.248 174.01 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -66.88 -36.98 83.55 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.048 1.295 . . . . 0.0 111.41 -175.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -55.19 -52.36 63.58 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.209 1.404 . . . . 0.0 109.766 174.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.474 ' HB3' HD11 ' A' ' 571' ' ' LEU . 13.8 mt -60.86 -55.42 33.22 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.11 0.964 . . . . 0.0 110.332 177.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.443 ' CD1' HD13 ' A' ' 571' ' ' LEU . 26.5 mm -63.61 -31.81 54.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 O-C-N 121.726 -0.609 . . . . 0.0 109.972 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.36 97.5 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.306 0.957 . . . . 0.0 109.927 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -69.06 -23.83 64.09 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 116.368 -1.777 . . . . 0.0 110.968 173.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.08 -41.0 74.67 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.795 2.543 . . . . 0.0 109.863 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -75.91 5.1 6.94 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -174.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.18 -79.98 0.14 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 119.176 0.898 . . . . 0.0 109.633 175.093 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.48 ' H ' HG23 ' A' ' 560' ' ' THR . 5.8 t-80 -47.39 -48.12 26.17 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 127.666 2.386 . . . . 0.0 113.662 -173.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 84.99 87.53 0.91 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 -173.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.3 172.52 11.03 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.78 158.7 24.18 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.268 0.627 . . . . 0.0 110.001 -175.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.46 -41.14 89.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.317 0.58 . . . . 0.0 109.44 174.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 566' ' ' GLU . . . . . 0.495 ' CD ' ' H ' ' A' ' 566' ' ' GLU . 23.5 mp0 -57.08 -52.9 63.44 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 129.068 2.947 . . . . 0.0 107.784 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -62.61 -39.94 95.38 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.554 1.542 . . . . 0.0 111.394 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -69.73 -23.75 63.44 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.177 -1.577 . . . . 0.0 110.271 177.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 57.0 mt -84.52 -38.99 19.37 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.145 1.378 . . . . 0.0 110.26 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -50.95 -44.49 60.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.844 1.202 . . . . 0.0 108.619 174.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 568' ' ' ARG . 17.5 mt -53.55 -40.95 65.96 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.999 0.92 . . . . 0.0 112.874 174.227 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 121.102 1.774 . . . . 0.0 109.21 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.2 m -56.69 -52.96 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.476 1.11 . . . . 0.0 108.776 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.9 tp -52.81 -47.95 67.26 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.561 1.545 . . . . 0.0 111.042 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -60.23 -37.82 81.52 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.711 0.804 . . . . 0.0 112.31 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -80.03 -35.74 36.8 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.426 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.76 -31.89 72.1 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.566 0.746 . . . . 0.0 109.9 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 32.1 mt -80.73 -15.14 57.26 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.071 0.948 . . . . 0.0 110.638 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 41.44 48.92 3.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.985 2.114 . . . . 0.0 112.133 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -129.99 169.25 15.49 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.283 1.033 . . . . 0.0 109.884 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 80.7 tttt . . . . . 0 C--O 1.235 0.303 0 C-N-CA 124.335 1.054 . . . . 0.0 108.668 -179.607 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.42 138.37 58.26 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.452 1.095 . . . . 0.0 110.357 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 449' ' ' THR . . . . . 0.732 HG21 ' CG ' ' A' ' 541' ' ' HIS . 92.6 m 65.62 123.39 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.407 1.067 . . . . 0.0 110.403 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 97.7 m -155.97 162.29 40.38 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.568 1.168 . . . . 0.0 110.417 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptm -55.0 -17.62 4.0 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.604 1.19 . . . . 0.0 111.037 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 23.5 mtt85 -74.9 -21.99 58.89 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.535 1.147 . . . . 0.0 110.34 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.504 HD13 ' HA ' ' A' ' 453' ' ' ILE . 1.8 mm -75.14 -45.43 41.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.506 1.129 . . . . 0.0 109.346 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.536 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 4.1 mm? -59.14 -47.23 86.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.578 1.174 . . . . 0.0 109.298 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.578 HG22 HD13 ' A' ' 519' ' ' LEU . 24.3 mt -72.79 -54.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.134 . . . . 0.0 109.265 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -45.46 -49.27 11.36 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.552 1.157 . . . . 0.0 111.005 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.726 HD11 HG22 ' A' ' 534' ' ' THR . 38.3 mt -66.1 -42.7 88.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.452 0.737 . . . . 0.0 109.33 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 465' ' ' ALA . 1.9 tm? -64.81 -26.91 68.55 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.517 1.136 . . . . 0.0 109.372 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.494 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 3.6 t -69.56 -52.56 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.446 1.091 . . . . 0.0 109.342 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 460' ' ' GLN . . . . . 0.407 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 4.4 mt-30 -75.49 -27.45 58.81 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.477 1.11 . . . . 0.0 110.23 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.739 ' HB3' HD12 ' A' ' 464' ' ' LEU . 3.1 t-20 -129.6 90.04 45.01 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.513 1.133 . . . . 0.0 109.269 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 -13.81 21.2 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.451 1.764 . . . . 0.0 111.028 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -77.11 -9.41 58.72 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.497 1.123 . . . . 0.0 110.311 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.766 HD22 ' CD2' ' A' ' 535' ' ' PHE . 18.7 mt -75.7 -15.16 60.33 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.443 1.089 . . . . 0.0 109.269 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.645 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -62.01 -31.53 71.92 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.517 1.136 . . . . 0.0 109.342 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 2.6 m -76.72 -13.22 60.06 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.53 1.144 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.689 HD12 HD23 ' A' ' 464' ' ' LEU . 19.5 mt -97.07 -9.12 28.69 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.53 1.144 . . . . 0.0 109.232 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.852 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.5 OUTLIER -97.62 146.43 31.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.483 1.114 . . . . 0.0 109.322 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.3 Cg_endo -75.01 175.29 11.44 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 124.457 1.767 . . . . 0.0 111.034 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 471' ' ' LEU . 18.5 Cg_endo -74.96 5.29 4.05 Favored 'Trans proline' 0 C--N 1.358 1.075 0 O-C-N 124.488 1.783 . . . . 0.0 111.018 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 1.021 ' CD1' HD12 ' A' ' 474' ' ' LEU . 3.4 mm? 68.63 70.49 0.29 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.484 1.115 . . . . 0.0 109.301 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.68 -62.51 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 0.0 110.296 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.88 -1.39 34.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.125 . . . . 0.0 109.319 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 1.021 HD12 ' CD1' ' A' ' 471' ' ' LEU . 7.6 mt -90.88 -61.97 1.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 1.191 . . . . 0.0 109.261 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 15.8 t0 60.77 152.81 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.498 1.124 . . . . 0.0 109.215 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -90.42 15.84 9.92 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.468 1.105 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -111.65 -34.04 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.49 1.119 . . . . 0.0 109.328 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -81.05 -21.17 40.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 0.0 109.317 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.458 ' CB ' ' HB2' ' A' ' 482' ' ' LEU . 46.4 mt -126.03 106.03 25.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.547 1.154 . . . . 0.0 109.313 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 73.98 4.17 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.502 1.79 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 152.18 -21.38 0.86 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.895 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.85 ' O ' HD13 ' A' ' 482' ' ' LEU . 2.1 tm? -54.3 -35.82 63.03 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 0.78 . . . . 0.0 109.336 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.29 -50.97 9.52 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.508 1.13 . . . . 0.0 111.047 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.47 -46.49 73.37 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.447 0.734 . . . . 0.0 109.348 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.536 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 46.8 t80 -65.55 -40.35 92.75 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.448 ' HB2' ' CD1' ' A' ' 482' ' ' LEU . 2.8 ttt85 -66.52 -49.12 67.56 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.511 1.132 . . . . 0.0 110.333 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.6 -47.22 80.09 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.495 1.122 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 1.009 HD11 HD21 ' A' ' 516' ' ' LEU . 1.4 mt -63.42 -49.69 72.74 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.507 1.129 . . . . 0.0 109.279 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.78 HG11 HG11 ' A' ' 468' ' ' VAL . 17.5 t -58.66 -49.75 81.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.529 1.143 . . . . 0.0 109.338 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -53.96 -39.38 65.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.474 1.109 . . . . 0.0 109.338 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' THR . . . . . 0.477 HG23 HE22 ' A' ' 495' ' ' GLN . 1.1 m -73.71 -44.19 57.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.117 . . . . 0.0 110.384 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.419 ' HA ' HD22 ' A' ' 498' ' ' LEU . 66.5 m -56.1 -46.43 79.1 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.508 1.13 . . . . 0.0 108.227 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -22.19 43.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.508 1.13 . . . . 0.0 109.279 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.19 -53.25 5.91 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.572 1.17 . . . . 0.0 109.998 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 495' ' ' GLN . . . . . 0.573 ' OE1' ' CD2' ' A' ' 506' ' ' HIS . 2.1 mp0 -61.51 110.99 3.62 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.433 1.083 . . . . 0.0 110.285 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 126.25 9.83 Favored 'Trans proline' 0 C--N 1.36 1.135 0 O-C-N 124.47 1.774 . . . . 0.0 110.919 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.06 41.32 99.84 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 124.479 1.112 . . . . 0.0 110.969 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.894 HD21 HD13 ' A' ' 503' ' ' LEU . 43.2 tp -58.46 164.87 2.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.54 0.788 . . . . 0.0 109.387 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 499' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 503' ' ' LEU . 6.3 p -142.95 170.51 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.46 1.1 . . . . 0.0 110.403 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 460' ' ' GLN . 2.3 m -66.56 -35.05 79.27 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.44 1.087 . . . . 0.0 110.372 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -83.92 -55.06 2.88 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.479 1.112 . . . . 0.0 111.033 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.6 tp-100 -50.81 -29.65 12.2 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.459 0.741 . . . . 0.0 110.287 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.894 HD13 HD21 ' A' ' 498' ' ' LEU . 21.9 tp -56.05 -58.81 6.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 0.0 109.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -56.98 -34.57 68.23 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.409 1.068 . . . . 0.0 109.357 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -64.32 -34.52 78.34 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' HIS . . . . . 0.573 ' CD2' ' OE1' ' A' ' 495' ' ' GLN . 68.8 t60 -71.69 -13.55 61.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 0.0 109.538 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.762 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 37.6 m-85 -124.22 27.24 7.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 0.0 111.071 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.26 126.98 31.21 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.507 1.129 . . . . 0.0 110.352 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.12 29.11 57.27 Favored Glycine 0 CA--C 1.529 0.947 0 O-C-N 124.453 1.095 . . . . 0.0 111.002 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.852 HG22 ' H ' ' A' ' 512' ' ' ASN . 19.0 m -109.02 136.78 47.97 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 0.763 . . . . 0.0 110.373 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 57.4 m-20 -58.75 -15.7 13.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.0 109.288 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.852 ' H ' HG22 ' A' ' 510' ' ' THR . 0.6 OUTLIER -97.41 -22.42 16.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.483 1.115 . . . . 0.0 109.268 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 513' ' ' ALA . . . . . 0.762 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.54 -36.08 9.93 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 0.0 109.263 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.49 41.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.452 1.095 . . . . 0.0 109.291 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 68.6 m -58.32 -42.42 86.7 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.461 1.1 . . . . 0.0 110.361 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 1.009 HD21 HD11 ' A' ' 488' ' ' LEU . 13.6 mt -66.56 -33.64 76.13 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.408 1.067 . . . . 0.0 109.335 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -68.21 -47.72 67.12 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.477 1.111 . . . . 0.0 110.277 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -56.21 -38.64 71.29 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 1.146 . . . . 0.0 109.332 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 455' ' ' ILE . 94.5 mt -72.4 -21.73 61.23 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.478 1.111 . . . . 0.0 109.31 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.9 t -68.74 -59.33 3.18 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 0.0 110.071 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' MET . . . . . 0.403 ' O ' ' C ' ' A' ' 522' ' ' TRP . 0.3 OUTLIER -77.38 2.18 16.72 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.458 1.099 . . . . 0.0 111.009 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.654 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.9 t90 -42.07 137.67 1.8 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.146 . . . . 0.0 107.918 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.56 1.89 8.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -66.77 -24.3 66.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.488 1.117 . . . . 0.0 109.402 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.654 HD11 ' CE3' ' A' ' 522' ' ' TRP . 0.7 OUTLIER -113.46 -59.81 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.484 1.115 . . . . 0.0 109.239 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.36 61.76 2.09 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.448 1.092 . . . . 0.0 109.31 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' ASP . . . . . 0.556 ' OD2' HD12 ' A' ' 530' ' ' ILE . 3.7 t70 -161.94 153.21 18.25 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.559 1.162 . . . . 0.0 109.325 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.414 ' O ' ' HB3' ' A' ' 531' ' ' ALA . 8.1 pttt -115.93 -36.98 3.98 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.609 1.193 . . . . 0.0 109.29 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.53 -43.68 38.24 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.426 1.079 . . . . 0.0 109.291 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' ILE . . . . . 0.556 HD12 ' OD2' ' A' ' 527' ' ' ASP . 55.0 mt -70.91 -12.39 16.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.461 1.101 . . . . 0.0 109.345 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 457' ' ' LEU . . . -61.36 -58.19 9.24 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.44 1.088 . . . . 0.0 109.295 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -53.47 -48.07 69.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.411 1.069 . . . . 0.0 110.299 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -43.63 93.85 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.459 1.1 . . . . 0.0 110.304 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 534' ' ' THR . . . . . 0.726 HG22 HD11 ' A' ' 457' ' ' LEU . 3.7 m -66.47 -36.08 81.87 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.429 1.08 . . . . 0.0 110.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.766 ' CD2' HD22 ' A' ' 464' ' ' LEU . 18.9 t80 -61.51 -51.6 67.96 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.565 1.166 . . . . 0.0 111.033 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 53.8 m -64.61 -46.91 80.6 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.517 1.136 . . . . 0.0 110.345 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -58.37 -41.18 84.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.533 1.145 . . . . 0.0 109.286 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.7 t -69.8 -56.49 7.0 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.992 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.611 HD11 HG23 ' A' ' 468' ' ' VAL . 0.7 OUTLIER -48.36 -43.54 33.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.483 1.114 . . . . 0.0 109.268 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.14 -38.26 90.42 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.496 1.122 . . . . 0.0 109.321 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' HIS . . . . . 0.732 ' CG ' HG21 ' A' ' 449' ' ' THR . 8.6 t-80 -62.71 -46.6 87.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.558 1.161 . . . . 0.0 109.601 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 542' ' ' MET . . . . . 0.412 ' O ' ' HG ' ' A' ' 546' ' ' LEU . 1.1 ttp -63.48 -44.9 93.08 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.478 1.111 . . . . 0.0 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.909 ' HA ' HD12 ' A' ' 546' ' ' LEU . 5.8 m-85 -68.84 -35.13 76.57 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.526 1.141 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.01 -44.85 83.56 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.52 1.138 . . . . 0.0 109.258 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.2 t -52.98 -37.65 61.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 0.0 109.994 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.909 HD12 ' HA ' ' A' ' 543' ' ' PHE . 1.2 mt -72.11 -50.58 26.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 0.0 109.234 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.409 HD22 HD11 ' A' ' 574' ' ' LEU . 79.1 mt -53.53 -36.15 61.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.542 1.151 . . . . 0.0 109.233 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -59.02 -55.33 36.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.8 -44.12 94.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.531 1.145 . . . . 0.0 109.304 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -48.85 62.59 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.527 1.142 . . . . 0.0 110.378 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 551' ' ' GLN . . . . . 0.543 ' HG3' HD23 ' A' ' 571' ' ' LEU . 27.1 tt0 -52.44 -45.7 66.11 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.528 1.142 . . . . 0.0 110.338 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.94 -47.76 79.2 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.548 1.155 . . . . 0.0 110.306 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -33.74 73.86 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.534 1.146 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.849 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.4 OUTLIER -69.87 -50.28 44.05 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 0.0 109.216 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 571' ' ' LEU . 28.0 mm -64.25 -30.6 50.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 124.523 1.139 . . . . 0.0 109.248 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' A' ' 560' ' ' THR . . . -57.14 -19.28 19.23 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.488 1.117 . . . . 0.0 109.346 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 557' ' ' ARG . . . . . 0.631 ' C ' HD23 ' A' ' 563' ' ' LEU . 7.8 mmt85 -104.44 3.43 32.17 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.546 1.154 . . . . 0.0 110.293 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 558' ' ' GLU . . . . . 0.587 ' HB2' HD21 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -104.86 -21.45 13.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.474 1.109 . . . . 0.0 110.298 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -108.83 7.62 26.26 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.609 1.193 . . . . 0.0 110.203 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 556' ' ' ALA . 16.9 p -114.01 -61.71 1.7 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.48 1.113 . . . . 0.0 110.362 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -118.93 -41.55 2.76 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.469 1.105 . . . . 0.0 109.567 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 562' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 558' ' ' GLU . . . 105.48 93.5 2.31 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.508 1.13 . . . . 0.0 111.028 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.631 HD23 ' C ' ' A' ' 557' ' ' ARG . 0.2 OUTLIER -55.83 -174.5 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 0.767 . . . . 0.0 109.265 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.37 145.85 55.64 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.061 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.754 ' O ' HD13 ' A' ' 569' ' ' LEU . 0.8 OUTLIER -52.94 -38.73 62.28 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.504 1.128 . . . . 0.0 109.265 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.51 -42.49 78.46 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.462 1.101 . . . . 0.0 110.312 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' GLU . . . . . 0.508 ' CB ' HD12 ' A' ' 563' ' ' LEU . 46.9 mm-40 -67.67 -41.16 84.15 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.557 1.161 . . . . 0.0 110.228 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.485 ' CG ' ' OE2' ' A' ' 558' ' ' GLU . 0.7 OUTLIER -60.56 -36.49 78.61 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.518 1.136 . . . . 0.0 110.217 -179.904 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 565' ' ' ASN . 7.6 mp -71.58 -37.62 70.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.493 1.12 . . . . 0.0 109.3 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -51.58 -37.65 50.76 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 110.367 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 555' ' ' ILE . 2.7 mt -60.21 -51.01 71.38 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.435 1.085 . . . . 0.0 109.29 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.603 ' CD2' ' N ' ' A' ' 573' ' ' THR . 0.0 OUTLIER -51.44 -57.55 8.68 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.503 1.127 . . . . 0.0 108.052 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.603 ' N ' ' CD2' ' A' ' 572' ' ' TRP . 1.4 m -55.12 -32.78 62.33 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.569 1.168 . . . . 0.0 110.421 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.409 HD11 HD22 ' A' ' 547' ' ' LEU . 1.5 tp -70.95 -41.41 71.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.359 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -59.6 -33.52 71.58 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 0.0 109.235 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -22.5 65.76 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.0 110.334 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.27 -27.63 24.28 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.586 1.179 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 579' ' ' ALA . 1.9 mt -87.03 -6.73 58.63 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.488 1.118 . . . . 0.0 109.341 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 579' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 578' ' ' LEU . . . -40.53 -65.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.546 1.154 . . . . 0.0 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.34 73.51 0.92 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.144 . . . . 0.0 109.378 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 O-C-N 124.472 1.108 . . . . 0.0 109.329 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.5 pttt . . . . . 0 C--O 1.22 -0.459 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? 53.59 -88.65 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.351 1.46 . . . . 0.0 109.466 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 3.7 t -83.25 172.42 12.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 120.347 1.43 . . . . 0.0 109.619 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 3.0 t -161.21 58.06 0.29 Allowed 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.681 1.592 . . . . 0.0 107.663 173.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 44.95 47.02 9.33 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.893 1.277 . . . . 0.0 110.08 -173.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.76 -46.28 0.87 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.024 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.492 HD12 HG23 ' A' ' 525' ' ' ILE . 18.7 mm -57.18 -52.4 56.86 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 124.305 1.042 . . . . 0.0 108.247 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.0 mt -51.74 -42.61 62.45 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-O 117.835 -1.079 . . . . 0.0 111.413 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.566 HD13 HD23 ' A' ' 484' ' ' LEU . 92.9 mt -65.43 -62.68 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 CA-C-N 119.614 1.097 . . . . 0.0 109.945 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -57.12 -40.59 91.76 Favored Glycine 0 C--N 1.337 0.587 0 CA-C-N 120.073 1.306 . . . . 0.0 113.58 -173.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.704 HD21 HG21 ' A' ' 525' ' ' ILE . 26.2 mt -67.42 -45.53 75.84 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -63.0 -33.83 76.25 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 119.153 0.888 . . . . 0.0 110.458 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.527 HG13 HD23 ' A' ' 503' ' ' LEU . 25.5 t -62.89 -51.52 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.489 -0.757 . . . . 0.0 109.394 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.41 -14.92 60.92 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.743 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -144.81 77.42 13.42 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 126.961 2.104 . . . . 0.0 109.165 -174.108 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.6 -13.75 35.54 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.256 1.971 . . . . 0.0 111.688 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.64 -23.07 63.43 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.701 1.601 . . . . 0.0 110.224 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 467' ' ' LEU . 56.1 mt -58.77 -18.13 29.2 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.79 1.177 . . . . 0.0 111.022 173.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 489' ' ' VAL . . . -63.3 -19.63 64.77 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.268 -0.895 . . . . 0.0 111.989 173.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 24.0 m -83.67 -18.71 37.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.879 0.872 . . . . 0.0 110.929 174.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 464' ' ' LEU . 81.9 mt -95.32 -19.15 20.2 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.673 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 489' ' ' VAL . 0.8 OUTLIER -72.01 150.27 92.53 Favored Pre-proline 0 CA--C 1.552 1.055 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 177.332 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.2 Cg_endo -74.69 172.92 15.28 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.958 3.106 . . . . 0.0 112.021 174.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.32 13.2 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 123.117 2.545 . . . . 0.0 114.339 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.642 HD13 HD12 ' A' ' 474' ' ' LEU . 2.6 mm? 61.79 60.59 1.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.262 2.225 . . . . 0.0 112.39 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.55 -68.88 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.353 1.061 . . . . 0.0 109.911 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -71.13 -0.55 9.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.642 HD12 HD13 ' A' ' 471' ' ' LEU . 17.7 mt -100.99 -81.72 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.23 1.012 . . . . 0.0 110.473 -175.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.1 t0 62.95 153.28 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.126 1.77 . . . . 0.0 112.37 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -75.49 -22.89 56.81 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.696 -1.253 . . . . 0.0 109.484 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -52.15 -46.57 65.48 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 125.483 1.513 . . . . 0.0 110.674 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -83.07 -29.9 28.43 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 47.0 mt -128.1 98.5 26.78 Favored Pre-proline 0 C--O 1.232 0.167 0 CA-C-N 119.698 1.136 . . . . 0.0 109.738 -173.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.46 -22.67 38.62 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.262 1.975 . . . . 0.0 112.328 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -89.62 -13.95 60.5 Favored Glycine 0 CA--C 1.525 0.716 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.291 174.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.74 -25.56 63.89 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.972 1.386 . . . . 0.0 110.233 175.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.67 -47.01 13.18 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.382 0.992 . . . . 0.0 111.944 173.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 0.566 HD23 HD13 ' A' ' 455' ' ' ILE . 39.8 tp -60.36 -49.56 77.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 117.734 0.767 . . . . 0.0 110.921 174.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -57.66 -51.28 70.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.567 1.076 . . . . 0.0 111.457 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -54.17 -52.77 60.11 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.044 0.937 . . . . 0.0 109.655 176.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -61.87 -43.75 98.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.755 0.707 . . . . 0.0 110.356 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.44 HD11 HD21 ' A' ' 516' ' ' LEU . 2.3 mp -54.99 -56.49 19.1 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.89 175.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 468' ' ' VAL . 75.6 t -57.25 -47.55 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.601 0.637 . . . . 0.0 109.78 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.09 -40.94 77.92 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.477 1.035 . . . . 0.0 109.856 -176.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 13.2 m -69.27 -39.77 78.18 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.226 1.411 . . . . 0.0 111.204 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.561 ' HA ' HD22 ' A' ' 498' ' ' LEU . 99.5 m -62.17 -40.71 96.94 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.047 1.294 . . . . 0.0 110.472 176.051 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.03 -24.55 66.02 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 125.313 1.445 . . . . 0.0 111.113 175.74 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 7.1 t -79.8 -53.41 6.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.808 0.843 . . . . 0.0 110.599 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -68.9 104.64 0.77 Allowed Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 125.516 1.526 . . . . 0.0 110.018 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.23 125.68 12.17 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.261 1.974 . . . . 0.0 109.582 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 64.34 36.15 92.85 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.561 HD22 ' HA ' ' A' ' 492' ' ' CYS . 20.3 tp -57.1 156.21 7.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.653 0.739 . . . . 0.0 109.647 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 3.4 p -142.66 168.17 20.35 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.336 1.454 . . . . 0.0 108.193 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -52.3 -46.23 65.85 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.049 0.94 . . . . 0.0 110.738 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -76.69 -43.96 16.99 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -62.32 -27.82 69.31 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.4 1.08 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.527 HD23 HG13 ' A' ' 459' ' ' VAL . 61.4 tp -59.03 -57.0 15.04 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 124.192 0.997 . . . . 0.0 108.506 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.659 HD21 ' HA ' ' A' ' 517' ' ' GLU . 11.2 mp -62.44 -31.54 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.535 177.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -63.37 -44.69 94.07 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.35 0.977 . . . . 0.0 110.657 176.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -63.88 -15.13 58.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.53 1.132 . . . . 0.0 111.887 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -116.23 21.61 13.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.982 1.313 . . . . 0.0 110.129 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -57.26 123.0 13.82 Favored 'General case' 0 C--O 1.227 -0.111 0 O-C-N 120.153 -1.592 . . . . 0.0 110.6 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 72.83 31.71 62.0 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.5 -0.611 . . . . 0.0 113.592 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.839 HG22 ' H ' ' A' ' 512' ' ' ASN . 38.7 m -101.6 148.54 25.1 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.643 1.577 . . . . 0.0 110.073 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.24 -15.71 27.15 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.613 -0.679 . . . . 0.0 112.754 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.839 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 m-20 -101.83 -21.46 14.58 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -177.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -44.86 -48.19 11.11 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 119.959 1.254 . . . . 0.0 110.101 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.82 81.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.766 1.167 . . . . 0.0 111.972 -177.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 54.1 m -63.21 -53.06 59.04 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 174.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.44 HD21 HD11 ' A' ' 488' ' ' LEU . 54.2 mt -55.14 -39.71 69.76 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 124.525 1.13 . . . . 0.0 110.552 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.659 ' HA ' HD21 ' A' ' 504' ' ' LEU . 9.9 tt0 -68.87 -46.12 69.26 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 127.671 2.388 . . . . 0.0 110.234 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -56.8 -42.92 80.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.517 HD13 HG22 ' A' ' 455' ' ' ILE . 90.5 mt -78.4 -14.37 59.42 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.378 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.1 t -73.03 -28.48 62.37 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.41 1.084 . . . . 0.0 110.432 174.068 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -2.15 21.31 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.095 1.358 . . . . 0.0 112.61 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.563 ' CE3' HD11 ' A' ' 525' ' ' ILE . 24.3 t90 -70.96 83.55 0.67 Allowed 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.8 0.84 . . . . 0.0 109.621 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -1.39 58.01 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.311 2.245 . . . . 0.0 111.312 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.18 51.23 0.67 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.481 2.313 . . . . 0.0 109.878 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.704 HG21 HD21 ' A' ' 457' ' ' LEU . 55.0 mt -135.85 -71.37 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.408 2.283 . . . . 0.0 107.542 -173.752 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -170.67 -89.87 0.01 OUTLIER 'General case' 0 C--N 1.351 0.633 0 C-N-CA 125.968 1.707 . . . . 0.0 110.755 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -164.8 164.54 21.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.897 3.279 . . . . 0.0 107.717 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 10.6 ttmm -62.27 -26.88 68.64 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.306 1.442 . . . . 0.0 110.331 173.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -78.41 -60.57 2.32 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 119.774 1.17 . . . . 0.0 110.386 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.87 -20.9 20.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.528 1.131 . . . . 0.0 110.638 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.503 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -50.44 -43.16 54.94 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.233 174.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -58.34 -48.32 80.93 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.502 1.501 . . . . 0.0 110.098 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -47.16 77.79 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.183 -0.948 . . . . 0.0 110.671 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 87.4 m -63.94 -26.44 68.59 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.159 1.384 . . . . 0.0 111.717 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.486 ' CD1' HD13 ' A' ' 464' ' ' LEU . 88.9 t80 -72.21 -52.98 14.0 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 119.855 1.207 . . . . 0.0 108.68 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 23.1 m -61.86 -40.44 95.34 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 123.788 0.68 . . . . 0.0 110.285 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.02 -43.9 98.21 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.725 1.148 . . . . 0.0 110.847 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.0 t -64.6 -48.32 75.38 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 124.977 1.311 . . . . 0.0 111.895 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.19 -52.03 64.66 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-O 118.019 -0.991 . . . . 0.0 108.535 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -57.46 -41.02 79.76 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 123.933 0.893 . . . . 0.0 111.328 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -63.18 -38.99 93.33 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.144 0.429 . . . . 0.0 110.728 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.11 -51.28 59.42 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 121.595 -0.691 . . . . 0.0 109.704 176.422 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CE1' HD11 ' A' ' 474' ' ' LEU . 12.4 m-85 -57.77 -46.94 83.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.586 0.754 . . . . 0.0 110.745 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -54.99 -50.88 67.88 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.868 2.067 . . . . 0.0 110.025 173.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 12.3 t -53.66 -47.83 70.02 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 123.389 0.676 . . . . 0.0 109.878 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.444 ' CD1' HD23 ' A' ' 474' ' ' LEU . 60.7 mt -67.16 -42.34 84.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 119.292 0.951 . . . . 0.0 110.638 -175.455 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.49 -38.14 88.88 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.976 0.911 . . . . 0.0 110.158 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -52.22 37.65 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 126.03 1.732 . . . . 0.0 110.003 178.048 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 31.7 mt -52.49 -50.57 62.5 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 125.259 1.423 . . . . 0.0 107.932 173.848 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -40.21 94.66 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 120.691 -1.255 . . . . 0.0 111.449 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 -60.01 -48.63 80.93 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.441 1.019 . . . . 0.0 108.329 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -42.08 95.44 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.331 -176.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -42.06 94.09 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.005 1.722 . . . . 0.0 110.282 -178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -73.03 -30.85 64.05 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.367 177.805 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.489 HD11 HD13 ' A' ' 571' ' ' LEU . 12.1 mm -76.18 -31.98 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 120.127 1.33 . . . . 0.0 110.341 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.89 -29.99 70.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.469 1.507 . . . . 0.0 108.094 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -90.58 15.37 11.01 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.328 1.451 . . . . 0.0 109.417 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -97.82 -50.58 4.38 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 122.186 2.267 . . . . 0.0 109.674 174.099 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -0.24 12.87 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.033 1.333 . . . . 0.0 113.537 -174.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.747 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.0 OUTLIER -131.89 -81.44 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 127.819 2.447 . . . . 0.0 108.984 179.385 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.747 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -56.12 -77.18 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.549 2.34 . . . . 0.0 106.605 -174.14 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 136.42 124.58 2.37 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.346 1.451 . . . . 0.0 110.027 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.466 HD22 ' HB3' ' A' ' 567' ' ' GLU . 10.4 mt -75.83 176.92 7.35 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.18 175.15 5.56 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.383 173.553 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.72 -42.31 97.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.47 -51.0 11.47 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.913 0.758 . . . . 0.0 108.977 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 567' ' ' GLU . . . . . 0.466 ' HB3' HD22 ' A' ' 563' ' ' LEU . 2.9 mp0 -59.16 -31.23 68.79 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 120.601 -1.312 . . . . 0.0 112.624 177.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.48 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -70.81 -33.28 70.55 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.997 -1.065 . . . . 0.0 109.735 174.785 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.57 -37.83 80.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 117.74 -1.124 . . . . 0.0 109.251 176.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.45 -41.52 14.02 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.983 1.265 . . . . 0.0 109.931 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 554' ' ' LEU . 3.0 mt -62.42 -40.81 97.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.737 -1.227 . . . . 0.0 113.585 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -45.54 91.32 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.82 -30.55 70.76 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 123.773 0.67 . . . . 0.0 110.305 -177.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.7 -36.24 62.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.39 1.476 . . . . 0.0 111.312 174.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -66.15 -34.79 78.84 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.165 -1.584 . . . . 0.0 110.435 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -30.85 63.79 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.459 176.374 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -67.13 -41.92 85.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.662 1.585 . . . . 0.0 111.045 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.14 -10.8 59.78 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.301 0.955 . . . . 0.0 111.884 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 33.93 56.0 0.59 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.972 2.509 . . . . 0.0 114.327 174.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.1 mttm 62.88 75.32 0.4 Allowed 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.523 1.529 . . . . 0.0 109.062 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.0 pttm . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 5.1 ttp85 91.66 59.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 129.605 3.162 . . . . 0.0 111.267 173.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 14.7 t -129.19 -161.75 1.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 0.0 108.328 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 32.6 m -156.87 152.88 27.34 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.751 2.02 . . . . 0.0 106.328 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptt? -51.08 -13.21 0.15 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 126.67 1.988 . . . . 0.0 114.786 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -63.66 -32.73 74.3 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 116.065 -1.922 . . . . 0.0 110.001 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.98 -53.14 46.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 CA-C-N 119.965 1.257 . . . . 0.0 108.749 174.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -44.5 70.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.029 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.417 HG22 HD13 ' A' ' 519' ' ' LEU . 93.1 mt -69.98 -53.77 22.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.41 -36.21 83.62 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.462 1.029 . . . . 0.0 113.313 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.42 HD21 HG21 ' A' ' 525' ' ' ILE . 53.3 mt -70.07 -39.08 75.84 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 117.575 0.687 . . . . 0.0 109.657 174.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.22 -37.68 86.32 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.699 0.681 . . . . 0.0 109.967 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' VAL . . . . . 0.419 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 4.1 t -59.18 -51.84 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.474 1.11 . . . . 0.0 109.118 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -75.29 -20.19 59.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.106 0.562 . . . . 0.0 111.248 -176.074 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -141.94 80.31 15.62 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 126.436 1.894 . . . . 0.0 110.094 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.62 -23.73 74.8 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.779 1.653 . . . . 0.0 113.612 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -64.36 -12.78 45.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.33 0.968 . . . . 0.0 112.921 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.507 HD22 ' CD2' ' A' ' 535' ' ' PHE . 34.2 mt -64.08 -16.23 61.29 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.673 -1.267 . . . . 0.0 109.564 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.46 -28.38 69.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.834 0.854 . . . . 0.0 110.873 173.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.9 m -83.86 -14.57 50.87 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.029 0.832 . . . . 0.0 112.15 173.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -92.75 -8.71 43.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 119.389 0.995 . . . . 0.0 111.755 176.486 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 489' ' ' VAL . 6.0 p -81.03 149.01 65.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 CA-C-N 120.406 1.457 . . . . 0.0 109.333 178.15 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.48 170.13 20.09 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.501 2.801 . . . . 0.0 111.446 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -72.6 10.83 0.92 Allowed 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.686 2.924 . . . . 0.0 114.073 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.527 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.8 mp 74.73 26.45 1.39 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 128.236 2.615 . . . . 0.0 115.088 173.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -55.57 -16.5 4.04 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -175.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.07 16.46 8.48 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.72 1.208 . . . . 0.0 111.555 -178.105 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.608 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 4.5 mp -122.88 -56.45 1.76 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.424 1.09 . . . . 0.0 109.156 -173.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 475' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' A' ' 477' ' ' ASN . 1.3 t70 50.1 24.03 1.3 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.418 1.887 . . . . 0.0 113.106 178.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 53.67 -11.66 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 1 C-N-CA 133.52 4.728 . . . . 0.0 114.169 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 477' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 475' ' ' ASP . 25.6 t30 -88.08 -35.08 17.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 131.512 3.925 . . . . 0.0 111.164 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -75.07 -9.29 58.4 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.552 1.524 . . . . 0.0 110.759 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.616 ' HG ' HD21 ' A' ' 546' ' ' LEU . 12.6 mt -135.79 96.19 13.44 Favored Pre-proline 0 N--CA 1.452 -0.332 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -71.3 82.13 1.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.8 2.333 . . . . 0.0 110.115 -177.209 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 143.99 -17.03 2.16 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.792 1.663 . . . . 0.0 113.353 -174.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 479' ' ' LEU . 2.2 tm? -67.89 -25.05 65.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.931 1.865 . . . . 0.0 109.928 174.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.26 -41.87 8.66 Favored Glycine 0 C--O 1.217 -0.927 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -46.31 87.46 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 118.906 1.353 . . . . 0.0 112.158 177.147 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -61.52 -49.93 74.73 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.56 0.744 . . . . 0.0 109.752 175.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.75 -49.97 70.89 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.183 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -56.74 -46.93 81.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.43 HD11 HD21 ' A' ' 516' ' ' LEU . 11.4 mt -56.42 -51.47 68.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.001 0.92 . . . . 0.0 111.518 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 468' ' ' VAL . 41.6 t -58.28 -44.31 87.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 119.486 1.039 . . . . 0.0 110.444 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -60.9 -45.53 94.24 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.455 1.502 . . . . 0.0 108.924 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 19.7 m -62.01 -42.77 99.52 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.496 1.518 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 81.1 m -64.96 -41.79 95.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 120.756 1.616 . . . . 0.0 110.816 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.3 -22.07 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.504 1.122 . . . . 0.0 111.978 174.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 19.8 t -88.65 -39.08 14.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.671 1.188 . . . . 0.0 111.286 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -76.19 105.51 2.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.249 1.02 . . . . 0.0 109.775 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.83 117.57 5.18 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 121.865 1.71 . . . . 0.0 110.513 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 71.05 35.12 64.6 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 177.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.449 HD21 HD13 ' A' ' 503' ' ' LEU . 21.4 tp -56.83 158.28 4.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.612 0.765 . . . . 0.0 111.17 175.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.62 168.92 18.37 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.603 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -50.48 -51.21 49.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.204 1.402 . . . . 0.0 110.686 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.79 -39.48 33.77 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -176.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -64.67 -25.45 67.95 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.307 0.643 . . . . 0.0 111.48 -177.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.449 HD13 HD21 ' A' ' 498' ' ' LEU . 57.3 tp -59.93 -52.52 65.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.562 0.745 . . . . 0.0 109.408 174.055 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.617 HD21 ' HA ' ' A' ' 517' ' ' GLU . 8.9 mp -62.95 -37.49 87.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.148 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.32 -39.1 85.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.11 0.564 . . . . 0.0 111.232 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -64.69 -20.52 66.36 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -114.9 16.47 17.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.444 1.497 . . . . 0.0 109.817 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -52.37 125.62 16.65 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.123 -1.61 . . . . 0.0 110.072 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 80.36 11.34 84.33 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.883 -0.954 . . . . 0.0 113.916 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.79 HG22 ' H ' ' A' ' 512' ' ' ASN . 35.2 m -93.27 147.4 22.95 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 120.133 1.966 . . . . 0.0 108.448 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.09 -15.63 46.54 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 177.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.79 ' H ' HG22 ' A' ' 510' ' ' THR . 0.1 OUTLIER -92.3 -17.85 24.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.694 1.598 . . . . 0.0 112.403 173.921 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.33 -38.27 68.51 Favored 'General case' 0 C--O 1.198 -1.654 0 C-N-CA 124.581 1.152 . . . . 0.0 110.466 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.14 -46.24 65.32 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 122.755 0.422 . . . . 0.0 110.618 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 97.7 m -61.58 -48.67 79.91 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.015 -1.053 . . . . 0.0 109.949 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 488' ' ' LEU . 94.9 mt -61.81 -40.66 96.02 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.678 0.791 . . . . 0.0 111.864 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.617 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.9 tt0 -62.8 -45.83 90.82 Favored 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.805 1.642 . . . . 0.0 108.532 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -63.32 -30.06 71.26 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.234 -0.889 . . . . 0.0 112.066 174.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.417 HD13 HG22 ' A' ' 455' ' ' ILE . 22.3 mt -85.37 -14.45 46.32 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.857 1.208 . . . . 0.0 113.237 176.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.8 t -75.01 -54.83 6.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.654 1.182 . . . . 0.0 108.175 177.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -74.53 13.01 0.67 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.068 2.147 . . . . 0.0 113.589 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -82.81 97.28 8.54 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.824 1.25 . . . . 0.0 113.265 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.0 14.11 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 129.134 2.973 . . . . 0.0 112.526 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -61.13 -25.07 66.73 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.425 1.89 . . . . 0.0 111.375 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.42 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -110.73 -48.55 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 127.683 2.393 . . . . 0.0 111.358 176.586 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.411 ' H ' HG12 ' A' ' 525' ' ' ILE . . . 52.31 20.51 1.41 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.119 2.568 . . . . 0.0 115.629 177.795 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -137.74 172.14 13.39 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.728 -1.232 . . . . 0.0 110.492 -173.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -124.29 -16.49 6.4 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.076 1.35 . . . . 0.0 113.844 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.36 -53.36 4.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.849 2.46 . . . . 0.0 107.756 175.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.34 -25.91 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.383 175.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.92 -59.52 4.05 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.962 1.305 . . . . 0.0 111.185 174.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.6 -44.08 80.77 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.05 0.841 . . . . 0.0 111.04 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -51.67 64.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.643 0.777 . . . . 0.0 109.793 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 53.1 m -66.36 -30.49 70.9 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.151 1.38 . . . . 0.0 110.825 -176.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.507 ' CD2' HD22 ' A' ' 464' ' ' LEU . 81.2 t80 -64.54 -56.18 15.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 176.003 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 98.2 m -59.46 -38.03 79.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.666 0.786 . . . . 0.0 111.258 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.11 -47.55 79.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.495 1.141 . . . . 0.0 111.237 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 24.5 t -65.62 -43.35 89.8 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 120.788 -1.195 . . . . 0.0 111.581 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.8 -50.28 63.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 118.989 0.813 . . . . 0.0 109.906 174.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -57.27 -43.97 83.55 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 123.346 0.658 . . . . 0.0 109.794 175.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.73 -40.61 88.44 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 119.312 0.96 . . . . 0.0 111.873 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.72 -51.89 67.69 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.33 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.608 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.0 m-85 -64.73 -41.97 95.56 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.867 0.867 . . . . 0.0 111.316 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.6 -49.73 74.04 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.344 2.258 . . . . 0.0 109.136 174.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 17.4 t -56.78 -43.79 81.21 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 123.471 0.708 . . . . 0.0 110.591 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.616 HD21 ' HG ' ' A' ' 479' ' ' LEU . 27.8 mt -68.45 -37.25 80.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.768 1.167 . . . . 0.0 110.358 -177.076 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 72.0 mt -70.27 -41.6 73.23 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.673 -0.68 . . . . 0.0 109.901 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.36 -50.82 68.43 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.347 1.459 . . . . 0.0 109.546 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.47 -47.14 73.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.072 0.949 . . . . 0.0 109.308 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -57.95 -44.84 87.22 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.303 0.956 . . . . 0.0 110.909 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -52.82 36.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.251 1.02 . . . . 0.0 109.87 173.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.08 -43.18 96.19 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.848 0.749 . . . . 0.0 110.53 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' GLU . . . . . 0.402 ' CG ' HH22 ' A' ' 557' ' ' ARG . 1.5 tp10 -59.98 -39.13 84.65 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.802 1.241 . . . . 0.0 110.096 -175.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.63 -53.28 56.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.561 1.544 . . . . 0.0 109.379 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 42.8 mm -60.58 -36.33 69.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-N 119.393 0.997 . . . . 0.0 110.93 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.0 -21.5 66.52 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.217 -1.552 . . . . 0.0 111.724 176.58 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 557' ' ' ARG . . . . . 0.402 HH22 ' CG ' ' A' ' 553' ' ' GLU . 4.2 ttm105 -84.57 -10.67 57.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 115.632 -2.128 . . . . 0.0 111.377 173.772 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -64.36 0.95 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 121.093 1.769 . . . . 0.0 110.257 174.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -71.56 3.23 4.11 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.816 1.247 . . . . 0.0 114.144 -173.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 46.8 p -118.72 -51.11 2.38 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.612 1.165 . . . . 0.0 111.343 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -50.56 2.83 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.734 1.214 . . . . 0.0 111.163 -174.434 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 123.5 131.91 3.86 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 126.29 1.9 . . . . 0.0 109.712 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.8 mt -86.56 137.85 32.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 6.3 t -68.86 167.3 15.9 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.224 1.012 . . . . 0.0 110.408 173.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -42.75 84.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.508 175.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -48.77 58.36 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 124.591 1.156 . . . . 0.0 109.823 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -60.7 -38.82 86.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.409 0.684 . . . . 0.0 110.858 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -62.48 -35.6 79.84 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.38 -0.825 . . . . 0.0 109.629 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 6.2 mp -71.96 -43.15 65.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 117.14 -1.41 . . . . 0.0 110.881 173.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -51.99 -37.49 53.36 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.469 1.031 . . . . 0.0 109.522 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.8 mt -62.9 -42.12 99.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 116.608 -1.663 . . . . 0.0 113.483 174.405 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -58.39 -44.96 89.17 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 121.37 1.896 . . . . 0.0 108.482 175.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -48.61 76.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -175.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.2 -42.11 98.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.74 1.216 . . . . 0.0 111.373 177.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -57.35 -45.36 84.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.365 0.666 . . . . 0.0 109.333 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -73.25 -27.45 61.59 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.135 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.09 -36.86 80.48 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.667 1.587 . . . . 0.0 109.564 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.4 mt -81.57 -25.96 35.37 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.799 0.84 . . . . 0.0 111.805 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 44.04 45.14 6.57 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.786 2.034 . . . . 0.0 113.327 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -147.04 179.58 7.51 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.075 -1.015 . . . . 0.0 110.235 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 118.429 -0.796 . . . . 0.0 110.953 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.6 tttt . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.9 163.67 34.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 120.181 1.355 . . . . 0.0 108.503 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 449' ' ' THR . . . . . 0.421 HG21 ' HA ' ' A' ' 538' ' ' SER . 0.5 OUTLIER -152.07 -176.16 5.54 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.315 178.009 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 450' ' ' THR . . . . . 0.476 HG22 ' HG2' ' A' ' 451' ' ' MET . 55.2 m -146.27 -85.95 0.11 Allowed 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 173.789 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 451' ' ' MET . . . . . 0.476 ' HG2' HG22 ' A' ' 450' ' ' THR . 14.9 ptt? -165.74 -44.05 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -178.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.96 -21.98 65.95 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 116.907 -1.52 . . . . 0.0 111.046 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.523 HD13 HG21 ' A' ' 525' ' ' ILE . 0.5 OUTLIER -53.1 -48.74 52.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 C-N-CA 126.181 1.792 . . . . 0.0 109.453 173.369 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 32.6 mt -53.5 -45.08 69.53 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 118.657 0.662 . . . . 0.0 109.906 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.559 HG23 HD13 ' A' ' 488' ' ' LEU . 95.7 mt -72.18 -51.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.341 176.204 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -65.04 -32.43 84.13 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-N 121.431 1.923 . . . . 0.0 113.373 -173.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.422 ' CD1' HG23 ' A' ' 453' ' ' ILE . 71.4 mt -70.39 -40.22 74.07 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.17 174.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -34.44 77.82 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.932 1.293 . . . . 0.0 109.99 174.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 16.4 t -60.65 -58.65 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 500' ' ' THR . 32.8 mt-30 -71.77 -22.32 61.61 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.19 -177.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.462 ' HB3' HD12 ' A' ' 464' ' ' LEU . 12.1 t-20 -135.44 77.53 53.13 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 127.051 2.141 . . . . 0.0 108.455 -176.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.08 -13.67 36.81 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 121.311 1.341 . . . . 0.0 112.485 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -70.49 -19.79 62.9 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.725 0.81 . . . . 0.0 111.323 173.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.462 HD12 ' HB3' ' A' ' 461' ' ' ASN . 36.0 mt -62.96 -15.66 56.69 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.399 1.454 . . . . 0.0 110.571 175.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.505 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -64.65 -30.97 72.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 119.36 0.982 . . . . 0.0 110.832 174.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.1 m -74.84 -19.48 60.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.997 0.817 . . . . 0.0 110.792 174.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 25.1 mt -91.0 -22.56 20.74 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 120.865 -1.147 . . . . 0.0 110.798 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -70.06 156.34 91.96 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 118.947 0.794 . . . . 0.0 110.244 179.299 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.673 ' HD2' HG22 ' A' ' 468' ' ' VAL . 23.0 Cg_endo -74.74 174.01 13.42 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 124.475 3.45 . . . . 0.0 112.448 176.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -76.71 12.04 1.77 Allowed 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 121.698 1.599 . . . . 0.0 113.519 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.564 HD22 ' HG3' ' A' ' 486' ' ' ARG . 10.2 mp 64.54 46.86 3.11 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.766 2.426 . . . . 0.0 112.428 176.259 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.03 -42.12 60.78 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -105.68 17.76 23.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.765 1.226 . . . . 0.0 111.053 -175.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.618 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.5 mm? -97.64 -77.56 0.5 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -173.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 31.3 t0 64.41 141.42 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.258 2.223 . . . . 0.0 112.781 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -68.44 -20.06 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 120.997 -1.065 . . . . 0.0 109.547 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -62.31 -45.61 92.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.93 1.292 . . . . 0.0 110.285 173.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -80.62 -35.74 33.6 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 121.661 -0.649 . . . . 0.0 110.124 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 546' ' ' LEU . 2.4 mm? -121.37 103.58 41.45 Favored Pre-proline 0 CA--C 1.534 0.344 0 C-N-CA 124.032 0.933 . . . . 0.0 108.876 -176.605 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.11 -20.45 33.19 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.544 1.496 . . . . 0.0 112.356 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.9 -8.9 61.47 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.703 -1.054 . . . . 0.0 112.742 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -32.33 71.05 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 116.256 -1.831 . . . . 0.0 109.721 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.46 -48.73 16.36 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.572 1.533 . . . . 0.0 111.238 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.68 -44.89 95.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.836 -0.803 . . . . 0.0 111.692 175.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 57.4 t80 -64.37 -48.79 74.15 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 119.115 0.871 . . . . 0.0 111.718 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.564 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.3 OUTLIER -54.23 -53.63 51.0 Favored 'General case' 0 CA--C 1.504 -0.811 0 C-N-CA 125.272 1.429 . . . . 0.0 108.186 175.737 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.07 -41.58 92.72 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.629 1.104 . . . . 0.0 110.872 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.559 HD13 HG23 ' A' ' 455' ' ' ILE . 3.4 mt -56.42 -56.86 15.88 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.136 0.974 . . . . 0.0 110.158 173.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 468' ' ' VAL . 53.5 t -58.7 -46.34 90.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.428 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -55.97 -46.45 78.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 125.779 1.632 . . . . 0.0 108.755 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 24.0 m -62.15 -44.13 97.3 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 125.81 1.644 . . . . 0.0 111.072 174.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.19 -37.12 86.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.069 0.849 . . . . 0.0 110.594 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -28.42 70.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.003 1.321 . . . . 0.0 109.679 174.329 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.67 -57.09 4.0 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.26 -0.9 . . . . 0.0 110.329 174.585 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -61.03 108.59 1.55 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.604 1.162 . . . . 0.0 110.241 -175.058 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -73.81 141.02 29.83 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 122.238 1.959 . . . . 0.0 109.398 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 50.24 33.58 23.59 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.097 1.332 . . . . 0.0 111.873 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 36.8 tp -54.03 156.3 3.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.976 1.37 . . . . 0.0 109.651 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' THR . . . . . 0.404 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.2 p -135.05 163.77 29.13 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.537 HG23 ' HA ' ' A' ' 460' ' ' GLN . 8.3 m -50.84 -46.97 60.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 125.593 1.557 . . . . 0.0 110.468 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.93 -41.6 27.38 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.404 ' HB3' ' H ' ' A' ' 499' ' ' THR . 28.1 tp60 -62.33 -24.67 67.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.609 -0.936 . . . . 0.0 110.459 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 40.9 tp -68.37 -45.36 72.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 119.606 1.094 . . . . 0.0 108.902 174.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.66 -38.62 85.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.608 -0.711 . . . . 0.0 111.012 175.677 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.26 -39.35 82.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.126 0.571 . . . . 0.0 111.355 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -66.98 -20.46 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 120.539 -1.35 . . . . 0.0 112.144 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -111.35 15.05 21.55 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.476 1.11 . . . . 0.0 109.931 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -54.63 128.59 33.09 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 119.985 -1.697 . . . . 0.0 110.173 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 76.7 15.42 81.6 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.272 -0.738 . . . . 0.0 114.108 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.83 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.7 m -93.98 145.95 24.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.885 1.343 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -59.41 -22.87 62.06 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.025 -1.047 . . . . 0.0 111.427 174.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.83 ' H ' HG22 ' A' ' 510' ' ' THR . 0.9 OUTLIER -92.63 -13.95 28.83 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 123.786 0.835 . . . . 0.0 112.533 178.593 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.29 -43.23 74.58 Favored 'General case' 0 C--O 1.209 -1.028 0 O-C-N 123.558 0.536 . . . . 0.0 109.735 173.55 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.46 -43.51 75.56 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 112.624 177.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 87.3 m -63.24 -50.06 71.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.376 -0.827 . . . . 0.0 109.141 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.516 HD21 HD11 ' A' ' 488' ' ' LEU . 48.7 mt -58.74 -42.15 88.11 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.565 0.746 . . . . 0.0 112.399 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.74 -42.74 81.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.304 1.842 . . . . 0.0 108.608 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -59.15 -30.68 68.33 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.515 -0.755 . . . . 0.0 111.01 173.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 56.3 mt -89.29 -3.86 58.35 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.19 0.905 . . . . 0.0 111.913 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.0 t -79.1 -50.48 10.97 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.117 1.367 . . . . 0.0 109.396 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.57 9.77 8.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.408 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' A' ' 525' ' ' ILE . 3.2 t90 -59.97 112.67 1.96 Allowed 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 125.556 1.542 . . . . 0.0 115.01 -173.321 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.96 -29.22 49.69 Favored 'General case' 0 C--N 1.326 -0.432 1 C-N-CA 131.76 4.024 . . . . 0.0 114.389 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -53.81 -27.31 28.57 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.224 1.81 . . . . 0.0 112.786 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.523 HG21 HD13 ' A' ' 453' ' ' ILE . 1.2 pt -123.53 -66.88 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 C-N-CA 124.673 1.189 . . . . 0.0 110.472 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.23 42.32 13.29 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.243 1.417 . . . . 0.0 114.005 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.58 172.13 13.24 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.856 -1.152 . . . . 0.0 111.4 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.44 -27.96 3.39 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.938 2.095 . . . . 0.0 111.906 175.32 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -80.9 -54.48 5.55 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.413 1.085 . . . . 0.0 108.513 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.84 -15.0 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 124.721 1.208 . . . . 0.0 109.598 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.417 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -61.41 -60.95 2.93 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 119.969 1.259 . . . . 0.0 110.746 173.879 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -55.96 -40.72 73.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.912 0.778 . . . . 0.0 111.31 -177.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -53.1 54.52 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.194 -0.316 . . . . 0.0 111.541 177.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 86.4 m -63.78 -27.39 69.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.184 0.993 . . . . 0.0 110.758 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.462 ' CD2' HD22 ' A' ' 464' ' ' LEU . 54.6 t80 -67.72 -53.25 28.97 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 120.173 1.351 . . . . 0.0 107.684 178.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 72.9 m -66.22 -39.09 89.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.291 -0.862 . . . . 0.0 111.213 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.38 -44.33 97.35 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.612 1.097 . . . . 0.0 109.614 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' SER . . . . . 0.421 ' HA ' HG21 ' A' ' 449' ' ' THR . 14.8 t -61.22 -55.11 35.82 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 120.954 -1.091 . . . . 0.0 110.604 176.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.12 -44.34 79.04 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 125.009 1.323 . . . . 0.0 108.831 -178.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.01 -44.0 98.06 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.353 0.979 . . . . 0.0 110.428 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -67.55 -40.75 84.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.891 0.769 . . . . 0.0 111.539 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.2 mmt -59.44 -53.1 62.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 121.14 -0.975 . . . . 0.0 109.504 173.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.618 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.6 m-85 -59.69 -45.09 93.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.545 0.738 . . . . 0.0 111.428 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -57.67 -46.76 83.83 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.051 1.34 . . . . 0.0 109.807 177.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.7 t -56.15 -39.12 71.8 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.484 0.714 . . . . 0.0 110.893 174.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 479' ' ' LEU . 38.2 mt -73.89 -35.04 64.65 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 120.675 -1.266 . . . . 0.0 110.819 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.8 -43.6 79.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.661 1.185 . . . . 0.0 108.737 175.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' GLU . . . . . 0.506 ' OE2' ' HE2' ' A' ' 581' ' ' LYS . 6.6 tt0 -59.49 -53.58 56.53 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.554 1.142 . . . . 0.0 110.571 174.103 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 56.5 mt -57.41 -43.21 83.56 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.815 -0.553 . . . . 0.0 110.325 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -59.29 -44.06 92.52 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 117.231 -1.366 . . . . 0.0 109.464 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.38 -50.74 66.8 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 119.329 0.968 . . . . 0.0 110.209 176.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -44.92 89.14 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.675 -0.678 . . . . 0.0 110.039 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -41.42 96.19 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.159 0.984 . . . . 0.0 109.769 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 10.7 mt -60.85 -52.46 64.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.602 1.561 . . . . 0.0 108.909 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.419 HD13 HD13 ' A' ' 571' ' ' LEU . 47.3 mm -61.62 -36.27 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-N 119.967 1.258 . . . . 0.0 111.162 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.47 -24.88 66.88 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.277 -1.514 . . . . 0.0 110.745 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -84.65 -7.03 59.38 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 115.808 -2.044 . . . . 0.0 111.659 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.13 -60.33 2.56 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 122.54 2.427 . . . . 0.0 106.525 173.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -76.08 -4.4 41.23 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.301 -1.499 . . . . 0.0 113.99 -173.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -114.88 -63.67 1.42 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 121.171 1.805 . . . . 0.0 109.884 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -74.89 -44.51 48.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.538 1.135 . . . . 0.0 111.499 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 111.99 3.98 26.17 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 116.339 -2.367 . . . . 0.0 113.65 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 4.1 mt 41.17 -159.05 0.01 OUTLIER 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 127.866 2.467 . . . . 0.0 110.915 -173.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 29.6 t -139.33 160.23 40.32 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -40.17 74.07 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.3 -52.09 13.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.884 0.874 . . . . 0.0 109.603 -178.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.96 -36.54 75.0 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.297 0.953 . . . . 0.0 111.325 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 17.8 ttt85 -61.83 -32.58 72.91 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.128 -1.608 . . . . 0.0 111.138 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 85.9 mt -80.71 -33.44 35.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.954 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -53.36 -46.1 69.44 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 555' ' ' ILE . 5.5 mt -56.45 -40.5 74.92 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 116.868 -1.539 . . . . 0.0 113.605 174.435 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.33 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 122.405 2.366 . . . . 0.0 109.071 175.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 2.8 m -62.31 -47.61 83.5 Favored 'General case' 0 CA--C 1.528 0.112 0 O-C-N 125.114 1.509 . . . . 0.0 107.215 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.28 87.24 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.712 -1.242 . . . . 0.0 111.001 177.236 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -65.08 -37.14 86.55 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.041 -1.037 . . . . 0.0 111.184 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -75.53 -25.38 57.14 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.679 -1.153 . . . . 0.0 110.364 175.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -45.58 77.6 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.416 1.007 . . . . 0.0 108.339 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 4.9 mt -80.46 -7.53 59.19 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.782 1.233 . . . . 0.0 112.844 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 31.23 50.07 0.11 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 128.271 2.628 . . . . 0.0 115.563 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.44 78.37 0.29 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.687 1.995 . . . . 0.0 109.888 -175.296 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 581' ' ' LYS . . . . . 0.506 ' HE2' ' OE2' ' A' ' 548' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.401 0 C-N-CA 127.916 2.486 . . . . 0.0 113.945 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.8 mptt . . . . . 0 C--O 1.224 -0.277 0 CA-C-O 120.908 0.385 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 27.8 mtt-85 -99.17 -68.51 0.8 Allowed 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 124.162 0.985 . . . . 0.0 108.863 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 1.1 m -159.9 146.0 15.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 -176.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 450' ' ' THR . 2.7 t -152.8 39.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 123.764 0.825 . . . . 0.0 109.582 175.237 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 79.6 -38.89 0.19 Allowed 'General case' 0 N--CA 1.481 1.105 0 O-C-N 121.174 -0.954 . . . . 0.0 110.841 177.502 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 71.2 mtt-85 -56.76 -27.64 59.81 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 115.513 -2.184 . . . . 0.0 109.978 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.8 mm -64.77 -53.22 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 119.858 1.208 . . . . 0.0 108.861 174.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.458 HD23 ' CE1' ' A' ' 535' ' ' PHE . 11.6 mt -59.44 -46.8 87.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.394 0.997 . . . . 0.0 110.147 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.647 ' CG2' HD13 ' A' ' 519' ' ' LEU . 15.7 mt -68.29 -57.87 7.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.999 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.973 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLY . . . . . 0.508 ' HA3' ' CE3' ' A' ' 522' ' ' TRP . . . -52.62 -42.52 58.4 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 126.285 1.898 . . . . 0.0 111.577 -178.318 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.883 HD21 HG21 ' A' ' 525' ' ' ILE . 97.4 mt -68.26 -44.25 76.0 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-O 117.693 -1.146 . . . . 0.0 109.686 173.662 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 458' ' ' LEU . 3.4 tm? -59.78 -30.78 69.12 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.626 1.103 . . . . 0.0 110.893 175.735 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.11 -49.94 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -74.96 -18.89 60.31 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.484 0.659 . . . . 0.0 111.922 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.751 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.6 t-20 -137.56 83.82 24.43 Favored Pre-proline 0 N--CA 1.44 -0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 107.862 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 23.8 Cg_endo -68.51 -19.86 42.15 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.596 1.531 . . . . 0.0 111.852 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.03 -28.54 70.16 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.214 173.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.817 HD22 ' CD2' ' A' ' 535' ' ' PHE . 15.8 mt -59.87 -16.98 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.609 -1.307 . . . . 0.0 111.766 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.711 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -60.08 -27.47 67.01 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.85 -0.531 . . . . 0.0 111.221 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 -16.51 49.56 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 120.139 -1.601 . . . . 0.0 112.847 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' LEU . . . . . 0.58 HD12 HD23 ' A' ' 464' ' ' LEU . 8.3 mt -85.16 -18.57 33.73 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.777 1.231 . . . . 0.0 108.827 175.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -66.87 148.63 98.78 Favored Pre-proline 0 N--CA 1.439 -0.99 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.782 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.668 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.6 Cg_endo -73.95 179.43 5.72 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 122.099 1.866 . . . . 0.0 111.04 178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -79.72 14.45 1.85 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.826 3.018 . . . . 0.0 112.208 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.541 HD13 HD12 ' A' ' 474' ' ' LEU . 0.3 OUTLIER 69.09 70.35 0.27 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 126.375 1.87 . . . . 0.0 107.693 174.412 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -105.39 -57.79 1.99 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.062 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -80.79 11.93 3.56 Favored 'General case' 0 CA--C 1.498 -1.046 0 C-N-CA 123.565 0.746 . . . . 0.0 112.491 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.841 HD13 HD21 ' A' ' 482' ' ' LEU . 36.8 mt -119.59 -49.99 2.33 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.915 0.886 . . . . 0.0 111.389 -173.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.4 t70 46.39 25.45 0.38 Allowed 'General case' 0 C--N 1.363 1.184 0 C-N-CA 128.6 2.76 . . . . 0.0 111.165 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 40.9 26.39 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 129.378 3.071 . . . . 0.0 112.874 -175.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -135.1 15.6 3.51 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 131.377 3.871 . . . . 0.0 111.607 -177.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.521 ' HB3' HD22 ' A' ' 546' ' ' LEU . 5.4 mmpt? -97.49 -42.76 7.56 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.591 174.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 482' ' ' LEU . 2.1 mm? -121.98 145.47 43.78 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -72.5 5.67 2.7 Favored 'Trans proline' 0 N--CA 1.477 0.544 0 C-N-CA 123.314 2.676 . . . . 0.0 114.258 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -125.32 -11.28 4.25 Favored Glycine 0 N--CA 1.44 -1.074 0 CA-C-O 116.752 -2.138 . . . . 0.0 109.593 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 479' ' ' LEU . 0.3 OUTLIER -53.35 -45.08 69.01 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 119.905 1.852 . . . . 0.0 107.565 -178.469 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -50.75 -49.5 40.7 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 176.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 30.2 tp -61.38 -53.19 59.81 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 118.281 1.041 . . . . 0.0 111.085 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 489' ' ' VAL . 12.6 t80 -52.41 -48.08 65.92 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 123.534 0.734 . . . . 0.0 110.865 175.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -59.67 -50.84 72.29 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.74 -44.56 96.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.818 0.847 . . . . 0.0 111.324 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.605 HD11 HD21 ' A' ' 516' ' ' LEU . 4.7 mt -59.17 -45.56 90.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.232 1.013 . . . . 0.0 109.755 177.705 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -65.69 -45.05 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.517 176.216 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -54.19 -42.85 70.18 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.379 1.071 . . . . 0.0 109.776 179.506 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.3 m -71.65 -43.26 66.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.173 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.477 ' HA ' HD22 ' A' ' 498' ' ' LEU . 57.4 m -55.85 -48.41 75.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.776 1.171 . . . . 0.0 109.583 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.1 -21.27 58.99 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 125.85 1.66 . . . . 0.0 110.745 177.276 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.48 5.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.075 0.95 . . . . 0.0 109.791 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 48.3 mm-40 -63.12 104.64 0.52 Allowed Pre-proline 0 N--CA 1.468 0.452 0 C-N-CA 125.837 1.655 . . . . 0.0 110.496 -176.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -70.5 133.21 23.71 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 121.328 1.352 . . . . 0.0 110.485 -178.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.79 37.91 52.8 Favored Glycine 0 N--CA 1.469 0.853 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 503' ' ' LEU . 43.3 tp -57.82 156.09 9.37 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.393 0.616 . . . . 0.0 109.935 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.48 168.36 19.08 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -174.417 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.0 m -58.18 -38.03 75.89 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.55 0.74 . . . . 0.0 110.041 173.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.18 -41.38 8.04 Favored Glycine 0 C--N 1.339 0.724 0 O-C-N 120.798 -1.189 . . . . 0.0 110.431 -177.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.496 ' HB3' HD12 ' A' ' 498' ' ' LEU . 39.3 tp60 -60.57 -27.87 68.02 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 117.679 -1.153 . . . . 0.0 109.691 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 498' ' ' LEU . 30.2 tp -64.39 -53.81 42.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 119.601 1.091 . . . . 0.0 109.646 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.3 mm? -61.28 -34.58 75.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.457 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -71.94 -35.46 69.63 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.327 0.651 . . . . 0.0 111.946 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -72.55 -5.21 35.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.089 2.156 . . . . 0.0 111.676 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.598 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 44.0 m-85 -122.83 18.29 10.21 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.864 1.666 . . . . 0.0 109.774 174.058 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.67 134.51 56.88 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 119.525 -1.985 . . . . 0.0 109.292 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 70.53 21.44 77.63 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.023 176.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.881 HG22 ' H ' ' A' ' 512' ' ' ASN . 95.3 m -94.43 144.78 25.27 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.341 1.571 . . . . 0.0 108.697 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -63.02 -17.27 62.03 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.469 -0.769 . . . . 0.0 109.11 173.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.881 ' H ' HG22 ' A' ' 510' ' ' THR . 42.8 m-80 -96.95 -20.59 17.99 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 119.318 -2.114 . . . . 0.0 111.246 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -45.18 -39.78 6.54 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 124.889 1.368 . . . . 0.0 109.278 178.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.48 20.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 111.201 177.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 98.4 m -57.86 -41.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.354 0 O-C-N 120.675 -1.265 . . . . 0.0 110.713 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.605 HD21 HD11 ' A' ' 488' ' ' LEU . 28.8 mt -64.96 -31.62 72.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.808 175.611 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.493 ' HA ' HD11 ' A' ' 504' ' ' LEU . 0.0 OUTLIER -72.94 -45.45 57.97 Favored 'General case' 0 CA--C 1.506 -0.75 0 C-N-CA 125.95 1.7 . . . . 0.0 109.284 -176.174 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -35.73 80.91 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 119.639 -0.825 . . . . 0.0 109.72 175.988 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.647 HD13 ' CG2' ' A' ' 455' ' ' ILE . 48.0 mt -77.69 -13.61 59.85 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 119.079 -0.486 . . . . 0.0 111.86 177.917 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 520' ' ' SER . . . . . 0.517 ' HB2' HD21 ' A' ' 504' ' ' LEU . 10.2 t -76.48 -60.82 2.18 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 126.012 1.725 . . . . 0.0 108.215 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -2.52 14.32 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 177.362 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.601 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.3 t90 -49.49 115.75 1.47 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 123.456 0.703 . . . . 0.0 109.962 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.09 2.76 35.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.925 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -54.87 -23.83 20.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 118.776 0.717 . . . . 0.0 112.411 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.883 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -109.68 -53.73 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 127.469 2.308 . . . . 0.0 109.493 178.878 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.28 47.61 5.63 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.627 1.571 . . . . 0.0 111.159 -178.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -161.11 151.05 17.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -174.639 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 -33.44 7.2 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.968 1.707 . . . . 0.0 113.021 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.96 -60.48 2.34 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 126.492 1.917 . . . . 0.0 109.456 177.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 87.2 mt -55.26 -29.39 23.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 117.071 -1.443 . . . . 0.0 107.173 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.439 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -46.9 -55.07 8.65 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.256 1.389 . . . . 0.0 111.514 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -56.4 -43.99 79.84 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.193 0.906 . . . . 0.0 110.23 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -48.35 79.43 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.372 177.48 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 40.2 m -64.14 -31.15 72.24 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.358 1.863 . . . . 0.0 108.281 -177.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.817 ' CD2' HD22 ' A' ' 464' ' ' LEU . 41.5 t80 -69.25 -59.28 3.12 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 124.853 1.261 . . . . 0.0 109.807 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -58.38 -40.16 81.57 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.493 178.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.57 -45.19 92.58 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 118.577 0.626 . . . . 0.0 112.151 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.9 t -67.48 -50.95 56.72 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 117.6 -1.191 . . . . 0.0 110.385 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -44.79 72.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.981 1.712 . . . . 0.0 108.567 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.88 -38.69 92.01 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 124.721 1.263 . . . . 0.0 110.532 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -72.42 -39.41 67.9 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 119.146 0.885 . . . . 0.0 109.051 -176.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -59.85 4.43 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 126.198 1.799 . . . . 0.0 107.462 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.643 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.3 m-85 -54.54 -46.47 73.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 125.014 1.446 . . . . 0.0 110.055 -179.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -56.97 -48.89 77.32 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.078 0.951 . . . . 0.0 109.254 178.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -47.59 67.22 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.521 HD22 ' HB3' ' A' ' 478' ' ' LYS . 20.4 mt -63.8 -45.77 88.16 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.219 -0.3 . . . . 0.0 110.359 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -37.02 73.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.495 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -63.06 -50.15 71.71 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.89 1.276 . . . . 0.0 109.519 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 1.4 mt -60.77 -48.45 81.75 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' ARG . . . . . 0.446 ' O ' HD12 ' A' ' 554' ' ' LEU . 4.1 ttp180 -57.13 -52.99 63.08 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.731 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -50.19 -54.05 23.62 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.725 1.21 . . . . 0.0 108.748 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -58.3 -39.26 78.86 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-O 117.832 -1.08 . . . . 0.0 109.832 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.43 -39.1 75.48 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 120.031 1.287 . . . . 0.0 112.629 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -65.38 -51.9 57.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 176.248 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 555' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 571' ' ' LEU . 28.2 mm -65.65 -36.28 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 123.528 1.632 . . . . 0.0 113.115 -179.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -59.84 -28.58 67.61 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 120.519 -1.363 . . . . 0.0 109.973 174.386 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.01 14.0 33.37 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 125.047 1.339 . . . . 0.0 110.983 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 558' ' ' GLU . . . . . 0.523 ' HG3' HD11 ' A' ' 563' ' ' LEU . 19.1 tt0 -100.64 -41.68 6.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 118.987 0.812 . . . . 0.0 109.182 176.981 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -79.48 -14.76 58.68 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.316 -0.865 . . . . 0.0 111.169 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 72.3 p -101.11 -88.51 0.37 Allowed 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -174.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -51.27 48.51 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 125.184 1.552 . . . . 0.0 108.312 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 89.76 79.49 1.34 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.609 1.576 . . . . 0.0 109.243 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.523 HD11 ' HG3' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -41.21 159.34 0.02 OUTLIER 'General case' 0 C--N 1.346 0.431 0 C-N-CA 127.012 2.125 . . . . 0.0 110.867 172.746 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.1 p -59.4 163.02 4.27 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 122.439 1.114 . . . . 0.0 109.776 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 565' ' ' ASN . . . . . 0.509 ' O ' HD23 ' A' ' 569' ' ' LEU . 0.7 OUTLIER -54.96 -42.16 72.02 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 110.742 173.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -62.59 -46.74 86.94 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.365 1.066 . . . . 0.0 110.102 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -64.26 -34.21 77.59 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.178 0.513 . . . . 0.0 111.051 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -37.96 88.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 121.165 -0.96 . . . . 0.0 110.64 176.13 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 569' ' ' LEU . . . . . 0.509 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.8 mm? -67.48 -44.34 78.77 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 117.657 -1.163 . . . . 0.0 108.905 178.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.72 -37.11 58.61 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 118.768 0.713 . . . . 0.0 110.52 179.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.1 mt -60.51 -51.54 69.0 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 115.57 -2.157 . . . . 0.0 112.154 174.414 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.422 ' HD1' HD13 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -45.97 -49.94 15.33 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 121.621 2.009 . . . . 0.0 109.536 174.855 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.95 -32.63 74.44 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.192 1.397 . . . . 0.0 110.628 -177.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.555 ' CD1' HD12 ' A' ' 578' ' ' LEU . 1.7 tm? -76.43 -43.05 41.88 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.532 1.133 . . . . 0.0 109.255 174.745 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.46 -46.53 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 119.253 -2.155 . . . . 0.0 108.6 -176.221 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.99 71.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.808 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -44.08 81.17 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.093 1.757 . . . . 0.0 107.89 -175.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.555 HD12 ' CD1' ' A' ' 574' ' ' LEU . 13.0 mt -82.18 -25.52 34.21 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.545 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 67.25 -53.05 0.48 Allowed 'General case' 0 C--O 1.238 0.487 0 C-N-CA 129.38 3.072 . . . . 0.0 112.009 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.77 110.53 1.94 Allowed 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.982 1.313 . . . . 0.0 108.662 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 115.342 -2.266 . . . . 0.0 113.879 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 105.91 166.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 134.755 5.222 . . . . 0.0 102.908 -172.644 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . 0.251 17.8 m 53.01 136.55 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.675 2.39 . . . . 0.0 114.921 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 450' ' ' THR . . . . . 0.518 HG22 ' H ' ' A' ' 452' ' ' ARG . 86.3 m -152.54 152.74 32.24 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 118.54 -2.6 . . . . 0.0 108.327 -178.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -54.02 -25.83 23.21 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.074 . . . . 0.0 113.175 174.248 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' ARG . . . . . 0.518 ' H ' HG22 ' A' ' 450' ' ' THR . 5.5 mpt_? -65.76 -39.17 90.77 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.762 -1.589 . . . . 0.0 111.692 173.905 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.8 mm -61.27 -53.18 52.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.6 mt -60.07 -45.75 91.86 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.458 1.026 . . . . 0.0 111.282 -175.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.55 -54.06 29.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.74 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -60.8 -32.1 78.08 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 119.741 1.155 . . . . 0.0 112.538 -175.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.29 -47.83 63.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 117.677 0.739 . . . . 0.0 109.392 173.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -59.9 -28.05 67.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.489 0.715 . . . . 0.0 111.001 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 40.0 t -68.33 -57.23 9.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.197 0 O-C-N 121.047 -1.033 . . . . 0.0 108.959 173.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.56 -18.48 61.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.735 -0.603 . . . . 0.0 111.665 -174.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -142.53 83.41 11.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 126.483 1.913 . . . . 0.0 109.623 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -70.79 -13.63 32.24 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 121.264 1.309 . . . . 0.0 112.975 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -68.51 -14.26 62.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.755 1.161 . . . . 0.0 110.464 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 67.0 mt -63.4 -13.6 41.45 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.157 -0.965 . . . . 0.0 109.584 173.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.41 -24.31 67.59 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.121 -0.987 . . . . 0.0 110.929 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.8 m -83.64 -13.99 52.95 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.234 0.924 . . . . 0.0 110.908 173.527 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.7 mt -94.8 -14.22 24.88 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.333 1.053 . . . . 0.0 112.047 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 489' ' ' VAL . 9.5 p -91.21 142.83 27.55 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 120.411 1.459 . . . . 0.0 108.869 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -68.61 170.67 14.63 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.05 13.07 0.15 Allowed 'Trans proline' 0 CA--C 1.554 1.512 0 C-N-CA 124.924 3.749 . . . . 0.0 115.213 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 474' ' ' LEU . 1.5 mm? 72.08 46.01 0.36 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.668 2.787 . . . . 0.0 113.359 173.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.39 -83.32 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.714 2.005 . . . . 0.0 111.694 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.13 -2.38 12.82 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 119.882 -1.761 . . . . 0.0 113.48 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.439 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 4.1 mm? -74.8 -76.62 0.14 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.256 1.823 . . . . 0.0 108.214 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 57.1 t0 62.25 131.71 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 124.139 1.923 . . . . 0.0 113.042 -177.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.47 -20.32 65.48 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.995 1.718 . . . . 0.0 110.394 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -73.08 -33.5 65.66 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.731 1.212 . . . . 0.0 110.456 174.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -80.67 -39.35 27.42 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.418 1.463 . . . . 0.0 111.812 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.589 HD21 HD11 ' A' ' 546' ' ' LEU . 1.5 mm? -119.09 118.22 32.94 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.96 2.74 2.84 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.136 1.891 . . . . 0.0 113.576 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -114.9 0.63 22.94 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 118.064 -1.409 . . . . 0.0 111.892 174.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 0.426 ' HB2' ' HB2' ' A' ' 479' ' ' LEU . 0.3 OUTLIER -63.48 -47.91 79.84 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 119.158 1.479 . . . . 0.0 108.138 176.744 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -51.53 -49.37 46.27 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 118.765 0.711 . . . . 0.0 112.116 -176.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.43 -47.29 86.72 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.695 -0.886 . . . . 0.0 110.732 177.863 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -65.1 -39.55 93.31 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.249 0.62 . . . . 0.0 111.214 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -60.75 -53.22 60.05 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 126.544 1.938 . . . . 0.0 108.378 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -58.45 -40.99 84.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.857 0.723 . . . . 0.0 110.04 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 516' ' ' LEU . 0.9 OUTLIER -56.14 -57.5 11.9 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.99 0.516 . . . . 0.0 111.704 174.337 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -60.09 -43.8 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 123.859 0.864 . . . . 0.0 110.205 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -57.59 -49.47 76.3 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.321 1.848 . . . . 0.0 109.245 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 96.7 m -58.95 -42.34 89.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.861 1.264 . . . . 0.0 110.758 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.92 -45.0 87.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.524 0.602 . . . . 0.0 109.802 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.89 -23.01 67.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.912 0.885 . . . . 0.0 112.226 174.305 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 6.1 t -86.28 -11.63 51.73 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.247 1.819 . . . . 0.0 113.45 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -133.22 75.47 70.84 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.19 1.796 . . . . 0.0 108.6 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.69 125.27 14.03 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.643 1.562 . . . . 0.0 109.586 -178.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 93.77 9.44 59.84 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.169 -175.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 1.7 tt -62.44 155.14 26.24 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.842 1.321 . . . . 0.0 108.24 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' THR . . . . . 0.5 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.1 p -127.21 169.8 13.09 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 123.85 0.86 . . . . 0.0 110.003 -173.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -50.01 -51.77 39.3 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.323 1.449 . . . . 0.0 109.962 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.22 -38.71 28.81 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -175.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.5 ' HB3' ' H ' ' A' ' 499' ' ' THR . 9.0 tp-100 -63.93 -25.77 68.29 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.73 -0.652 . . . . 0.0 110.728 179.024 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 18.7 tp -63.48 -44.4 94.53 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.417 1.008 . . . . 0.0 111.014 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 520' ' ' SER . 10.0 mp -65.57 -40.8 93.18 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -63.7 -38.3 90.58 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -70.91 -20.67 62.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.092 -1.005 . . . . 0.0 112.947 -179.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -106.72 11.94 29.73 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.464 1.106 . . . . 0.0 109.682 174.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.0 ttt180 -56.52 128.71 37.5 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 120.33 -1.481 . . . . 0.0 111.005 -174.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.23 5.93 86.81 Favored Glycine 0 CA--C 1.535 1.291 0 CA-C-O 118.495 -1.17 . . . . 0.0 113.502 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.838 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -93.93 147.18 23.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 119.59 1.695 . . . . 0.0 107.382 -174.508 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -59.4 -17.71 32.75 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 120.691 -1.256 . . . . 0.0 113.328 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.838 ' H ' HG22 ' A' ' 510' ' ' THR . 7.5 m-80 -92.96 -19.47 21.58 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-O 117.756 -1.116 . . . . 0.0 110.973 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -46.27 -50.09 16.54 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.64 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.88 -45.3 64.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 0.0 112.178 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 25.8 m -58.42 -49.66 76.48 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.972 -0.537 . . . . 0.0 110.669 173.37 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 488' ' ' LEU . 35.1 mt -67.6 -35.76 79.59 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 123.788 0.835 . . . . 0.0 111.516 -176.968 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.13 -47.61 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.911 2.084 . . . . 0.0 107.611 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.26 -29.88 70.11 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 117.509 -1.234 . . . . 0.0 112.213 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 81.8 mt -89.44 -10.86 44.83 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.51 1.05 . . . . 0.0 112.263 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 520' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 504' ' ' LEU . 18.3 t -77.64 -54.08 6.81 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.454 1.502 . . . . 0.0 109.819 174.047 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.78 19.1 1.76 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.751 1.221 . . . . 0.0 112.571 -178.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -74.95 102.23 4.72 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 116.816 2.154 . . . . 0.0 116.816 -172.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -3.74 18.65 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 129.755 3.222 . . . . 0.0 113.693 178.403 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.91 -20.39 52.96 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.138 -0.976 . . . . 0.0 111.379 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.12 -63.28 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 126.01 1.724 . . . . 0.0 109.701 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 46.27 25.12 0.33 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.807 2.043 . . . . 0.0 115.889 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -126.23 177.11 6.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.036 1.335 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.32 -21.66 2.29 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.32 1.448 . . . . 0.0 112.982 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.22 -56.95 3.11 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.751 2.02 . . . . 0.0 108.036 174.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 43.1 mt -58.51 -31.37 43.31 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.264 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -51.32 -54.17 28.76 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 118.651 0.66 . . . . 0.0 112.251 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.77 -45.98 84.07 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.312 0.505 . . . . 0.0 109.91 -177.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.15 -44.74 94.74 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.108 0.563 . . . . 0.0 110.972 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 96.8 m -69.1 -30.81 69.18 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.503 176.049 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -62.13 -55.15 31.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 120.879 1.672 . . . . 0.0 108.698 174.404 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.6 m -60.36 -41.41 93.63 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.055 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.97 -47.32 78.01 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.919 0.781 . . . . 0.0 111.929 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 46.5 t -61.21 -50.01 74.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.499 1.52 . . . . 0.0 111.536 177.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.42 -49.48 72.3 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.152 1.381 . . . . 0.0 110.138 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -58.62 -46.08 87.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 118.193 -0.908 . . . . 0.0 109.735 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -62.34 -40.29 95.89 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 119.313 0.961 . . . . 0.0 110.667 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -52.73 64.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 4.5 m-85 -63.22 -45.6 90.9 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.671 0.788 . . . . 0.0 111.296 -177.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -52.46 -49.04 65.44 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.764 2.426 . . . . 0.0 109.477 175.583 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 10.7 t -60.7 -41.36 95.03 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.146 0.579 . . . . 0.0 111.9 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 479' ' ' LEU . 86.5 mt -67.76 -34.74 77.41 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.681 -1.262 . . . . 0.0 110.788 178.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 77.8 mt -70.82 -39.72 72.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.271 1.428 . . . . 0.0 110.551 176.141 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.06 -48.01 77.89 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.231 1.412 . . . . 0.0 108.865 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.6 -48.03 80.53 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 123.473 0.709 . . . . 0.0 109.575 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -62.26 -42.04 98.98 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.739 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -55.41 -50.08 70.69 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 118.604 -0.713 . . . . 0.0 110.104 173.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.16 90.07 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 119.448 1.022 . . . . 0.0 109.549 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -66.36 -35.89 81.5 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.267 0.556 . . . . 0.0 110.202 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.511 HD12 ' C ' ' A' ' 554' ' ' LEU 0.282 0.2 OUTLIER -77.15 -39.64 48.43 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.332 1.053 . . . . 0.0 111.028 176.991 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.1 mm -66.59 -33.16 61.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 120.965 1.711 . . . . 0.0 108.791 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.05 71.79 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.296 -1.503 . . . . 0.0 110.045 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 13.3 mtp-105 -74.01 -8.24 55.38 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 117.043 -1.456 . . . . 0.0 111.957 173.35 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -61.82 1.82 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 123.144 2.702 . . . . 0.0 111.77 174.188 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -68.04 -18.66 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.108 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 75.1 p -95.98 -88.52 0.27 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -66.7 -56.93 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.575 1.15 . . . . 0.0 112.343 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 127.21 121.26 2.42 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.542 1.544 . . . . 0.0 110.557 -174.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.93 150.9 37.43 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.442 1.121 . . . . 0.0 112.013 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 35.4 t -78.14 164.59 24.84 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.789 1.635 . . . . 0.0 108.231 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.96 -42.04 99.71 Favored 'General case' 0 C--O 1.226 -0.164 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -69.64 -50.43 44.28 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 -176.274 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -60.49 -33.82 73.15 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.86 -0.525 . . . . 0.0 111.382 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 568' ' ' ARG . . . . . 0.512 ' HA ' HD12 ' A' ' 571' ' ' LEU . 52.9 ttt85 -66.22 -34.21 77.5 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.301 -0.875 . . . . 0.0 109.974 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 80.9 mt -73.09 -34.33 66.14 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.638 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -53.92 -36.43 62.74 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.328 0.967 . . . . 0.0 109.305 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 568' ' ' ARG . 6.3 mt -61.71 -39.32 91.08 Favored 'General case' 0 CA--C 1.519 -0.222 0 O-C-N 120.822 -1.174 . . . . 0.0 112.426 175.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -45.88 91.17 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.037 1.744 . . . . 0.0 108.148 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 3.7 m -66.37 -49.55 66.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 123.81 0.694 . . . . 0.0 109.285 -174.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 6.2 tp -55.1 -43.35 73.91 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.171 1.788 . . . . 0.0 111.286 175.123 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -64.56 -39.34 93.57 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.903 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -73.37 -34.15 65.42 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.649 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -67.04 -37.19 83.65 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 119.407 1.003 . . . . 0.0 109.469 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.0 mt -76.91 -20.83 55.72 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 120.487 -1.383 . . . . 0.0 109.718 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -74.03 -32.52 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.518 -0.738 . . . . 0.0 111.359 175.565 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -115.88 81.31 1.58 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.054 1.297 . . . . 0.0 110.84 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 173.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' LYS . . . . . 0.431 ' HE3' ' OD1' ' A' ' 537' ' ' ASP . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 49.18 76.15 0.13 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.206 1.402 . . . . 0.0 110.752 -178.668 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.6 t -100.31 140.39 34.62 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 124.825 1.25 . . . . 0.0 109.085 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 14.4 t -136.0 68.61 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 -175.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' MET . . . . . 0.501 ' O ' HD12 ' A' ' 455' ' ' ILE . 10.1 mtm 49.42 29.76 3.0 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.005 0.922 . . . . 0.0 111.626 -176.342 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -112.06 -55.12 2.55 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 124.698 1.199 . . . . 0.0 108.464 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.7 mm -56.76 -46.81 83.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -54.51 -55.12 32.35 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.378 0.99 . . . . 0.0 110.356 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 1.088 HD13 HD23 ' A' ' 484' ' ' LEU . 23.2 mt -65.34 -49.04 80.86 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.933 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.2 -38.88 96.35 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 124.048 0.833 . . . . 0.0 111.929 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.568 HD22 ' HB1' ' A' ' 531' ' ' ALA . 52.1 mt -66.37 -45.15 81.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.723 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -34.45 71.26 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.99 0.916 . . . . 0.0 111.871 174.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.23 -53.9 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 124.913 1.285 . . . . 0.0 109.942 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -80.63 -20.94 42.02 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 122.141 -0.35 . . . . 0.0 111.32 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.584 ' HB3' HD12 ' A' ' 464' ' ' LEU . 17.7 t-20 -130.07 81.05 69.75 Favored Pre-proline 0 C--N 1.323 -0.549 0 C-N-CA 124.001 0.921 . . . . 0.0 108.993 -173.626 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 462' ' ' PRO . . . . . 0.423 ' HB3' HD23 ' A' ' 498' ' ' LEU . 36.2 Cg_endo -64.56 -22.54 64.93 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.994 1.796 . . . . 0.0 111.21 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.16 -22.58 62.96 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.155 0.982 . . . . 0.0 110.686 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 461' ' ' ASN . 38.8 mt -63.67 -12.11 31.3 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.7 -1.25 . . . . 0.0 111.362 173.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -66.76 -28.05 68.09 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 120.907 -1.12 . . . . 0.0 111.209 174.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 31.9 m -83.65 -21.83 32.34 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.904 0.882 . . . . 0.0 110.906 173.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -14.8 47.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.777 0.717 . . . . 0.0 112.773 175.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 489' ' ' VAL . 5.7 p -77.79 145.48 70.66 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 120.166 1.348 . . . . 0.0 109.21 176.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.556 ' HD2' HD11 ' A' ' 539' ' ' LEU . 13.3 Cg_endo -68.67 170.43 15.24 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.513 2.809 . . . . 0.0 111.483 173.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -74.46 12.92 0.99 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.413 2.742 . . . . 0.0 114.277 175.706 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.639 ' HG ' HD12 ' A' ' 474' ' ' LEU . 6.6 mp 72.46 43.07 0.5 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.153 2.181 . . . . 0.0 112.698 174.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -65.81 -30.76 71.44 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -126.06 17.41 7.85 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.566 1.546 . . . . 0.0 110.536 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.639 HD12 ' HG ' ' A' ' 471' ' ' LEU . 61.3 mt -100.85 -101.68 0.25 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.246 1.019 . . . . 0.0 109.173 178.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.3 t0 70.97 147.15 0.07 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 128.141 2.577 . . . . 0.0 109.979 -173.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.85 -25.85 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.844 1.658 . . . . 0.0 109.622 173.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.16 -33.55 71.04 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 122.969 0.508 . . . . 0.0 111.229 175.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 546' ' ' LEU . 54.9 mttt -92.38 -24.33 18.93 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 112.26 0.466 . . . . 0.0 112.26 176.772 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 546' ' ' LEU . 0.9 OUTLIER -125.84 96.15 38.36 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -177.015 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.16 67.31 4.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.579 2.852 . . . . 0.0 111.394 -174.497 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 163.52 -23.33 0.18 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 127.019 2.247 . . . . 0.0 112.308 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.1 tp -60.66 -23.98 65.23 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.633 -0.922 . . . . 0.0 110.814 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -49.07 -35.26 18.46 Favored Glycine 0 C--O 1.222 -0.655 0 CA-C-N 119.136 0.88 . . . . 0.0 111.326 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' LEU . . . . . 1.088 HD23 HD13 ' A' ' 455' ' ' ILE . 6.4 tp -61.16 -43.44 98.87 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.72 1.26 . . . . 0.0 111.337 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.33 -51.25 61.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 124.572 1.149 . . . . 0.0 110.845 176.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -53.84 -50.6 65.85 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.596 0.634 . . . . 0.0 111.12 -178.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -50.91 69.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 117.851 0.296 . . . . 0.0 110.964 174.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 468' ' ' VAL . 73.9 t -62.1 -45.61 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.264 176.367 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -55.61 -46.37 77.34 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.324 1.05 . . . . 0.0 109.353 -176.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 95.5 m -61.67 -46.77 88.29 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.178 2.191 . . . . 0.0 110.654 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 69.4 m -63.14 -44.16 96.33 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.155 0.889 . . . . 0.0 110.321 -178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -23.18 64.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.105 1.362 . . . . 0.0 112.085 174.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.28 -51.23 8.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.169 1.388 . . . . 0.0 110.293 177.397 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -71.3 100.48 0.3 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 127.062 2.145 . . . . 0.0 110.504 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.43 115.01 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.287 2.658 . . . . 0.0 111.574 -173.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.58 34.01 54.76 Favored Glycine 0 CA--C 1.522 0.478 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.252 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.633 HD21 HD13 ' A' ' 503' ' ' LEU . 15.9 tp -54.74 154.43 5.06 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.643 0.735 . . . . 0.0 110.242 174.078 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.96 163.98 26.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.2 1.4 . . . . 0.0 108.565 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -52.76 -45.32 67.01 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.911 0.884 . . . . 0.0 110.583 175.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -80.24 -31.96 36.62 Favored Glycine 0 C--N 1.338 0.691 0 CA-C-O 118.899 -0.945 . . . . 0.0 111.081 -176.51 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -40.24 95.71 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 118.363 1.081 . . . . 0.0 108.751 174.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.633 HD13 HD21 ' A' ' 498' ' ' LEU . 16.5 tp -52.93 -53.08 54.75 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.906 0.776 . . . . 0.0 109.562 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.69 -40.72 84.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.102 0.41 . . . . 0.0 111.661 176.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.14 -40.14 96.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.759 0.423 . . . . 0.0 111.078 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -67.4 -20.57 65.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.359 1.464 . . . . 0.0 111.646 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' TYR . . . . . 0.525 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 66.5 m-85 -108.15 17.54 22.17 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.695 1.598 . . . . 0.0 109.217 176.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 15.5 ttt180 -59.7 133.88 56.5 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 119.901 -1.749 . . . . 0.0 110.166 -175.52 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 63.43 18.71 61.38 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 121.712 -0.618 . . . . 0.0 113.256 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.811 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.7 m -93.12 140.79 29.13 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -178.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -20.45 16.73 Favored 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.811 ' H ' HG22 ' A' ' 510' ' ' THR . 1.1 m120 -94.16 -19.5 20.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.068 1.347 . . . . 0.0 109.715 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.98 -45.53 31.65 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -53.75 -43.81 69.44 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.949 1.3 . . . . 0.0 112.1 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.5 m -62.85 -49.82 73.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.562 0.745 . . . . 0.0 109.042 173.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.1 mt -62.16 -35.73 79.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.404 1.081 . . . . 0.0 112.558 -178.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -34.29 62.07 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.583 2.353 . . . . 0.0 108.75 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.2 -43.31 98.51 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 173.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 24.4 mt -71.17 -22.39 62.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.548 1.139 . . . . 0.0 110.626 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 41.1 t -62.34 -53.99 46.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 120.744 1.611 . . . . 0.0 109.496 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.82 20.28 4.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.875 1.27 . . . . 0.0 111.397 -175.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -70.57 126.76 30.52 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.386 0.674 . . . . 0.0 111.324 -173.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.05 -2.45 37.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.06 1.344 . . . . 0.0 111.424 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -68.74 -27.68 66.14 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.818 -1.176 . . . . 0.0 111.988 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.82 -67.32 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 C-N-CA 126.026 1.731 . . . . 0.0 107.974 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 37.94 52.02 1.46 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.586 1.554 . . . . 0.0 112.14 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -148.27 167.84 24.09 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.947 1.299 . . . . 0.0 109.464 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -120.63 -32.41 4.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.091 2.156 . . . . 0.0 111.597 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -83.38 -55.05 4.54 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.261 1.424 . . . . 0.0 109.413 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.92 -25.89 39.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.256 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.568 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -53.9 -54.03 44.35 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.134 174.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -57.83 -46.03 85.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.19 0.995 . . . . 0.0 110.67 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -66.55 -46.92 74.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.767 -0.583 . . . . 0.0 110.104 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 41.6 m -62.25 -28.05 69.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.513 1.525 . . . . 0.0 110.453 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.467 ' CD1' HD13 ' A' ' 464' ' ' LEU . 43.0 t80 -66.23 -57.66 7.08 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 120.957 1.708 . . . . 0.0 108.641 176.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 17.8 m -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.346 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' ASP . . . . . 0.431 ' OD1' ' HE3' ' A' ' 447' ' ' LYS . 34.4 t0 -63.91 -46.81 83.15 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.452 1.024 . . . . 0.0 111.758 177.507 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 29.3 t -65.72 -48.74 70.94 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.032 1.333 . . . . 0.0 110.59 177.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.556 HD11 ' HD2' ' A' ' 469' ' ' PRO . 2.4 tt -55.27 -52.4 63.54 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-O 117.544 -1.217 . . . . 0.0 109.031 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -59.99 -40.19 88.33 Favored 'General case' 0 C--O 1.214 -0.798 0 O-C-N 124.04 0.838 . . . . 0.0 109.927 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -66.34 -32.8 74.42 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.492 1.042 . . . . 0.0 110.395 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 2.3 ttm -66.92 -58.99 3.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.442 ' CD1' HD21 ' A' ' 474' ' ' LEU . 25.7 m-85 -57.88 -45.16 86.8 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.906 1.283 . . . . 0.0 110.166 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -55.6 -50.52 69.9 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.245 1.818 . . . . 0.0 109.513 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 5.0 t -57.97 -42.09 84.29 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 118.552 0.615 . . . . 0.0 110.187 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 479' ' ' LEU . 17.6 mt -72.57 -35.2 67.89 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.371 0.987 . . . . 0.0 110.519 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 26.5 mt -67.95 -40.0 83.34 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.241 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -62.19 -58.33 8.17 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 126.242 1.817 . . . . 0.0 108.379 174.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.98 -54.83 40.04 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.768 1.627 . . . . 0.0 109.814 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -49.85 76.16 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 124.88 1.272 . . . . 0.0 110.1 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 551' ' ' GLN . . . . . 0.427 ' O ' HD23 ' A' ' 554' ' ' LEU . 0.5 OUTLIER -49.59 -56.02 11.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 116.245 -1.836 . . . . 0.0 108.656 173.634 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -60.3 -35.41 75.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.266 1.393 . . . . 0.0 109.956 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -44.81 88.86 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 121.565 -0.709 . . . . 0.0 111.197 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 571' ' ' LEU 0.267 0.0 OUTLIER -80.07 -44.81 19.4 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.372 177.689 . . . . . . . . 4 4 . 1 . 019 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -39.6 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.942 1.701 . . . . 0.0 108.043 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 556' ' ' ALA . . . . . 0.501 ' O ' HG22 ' A' ' 560' ' ' THR . . . -58.76 -39.43 80.95 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.636 -1.29 . . . . 0.0 109.759 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.51 -13.08 18.12 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 116.014 -1.946 . . . . 0.0 110.01 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 558' ' ' GLU . . . . . 0.584 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -72.47 -58.04 3.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 122.306 2.321 . . . . 0.0 109.256 173.574 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -63.59 -27.69 69.42 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 560' ' ' THR . . . . . 0.502 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.6 t -99.6 -82.4 0.44 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 561' ' ' HIS . . . . . 0.502 ' H ' HG23 ' A' ' 560' ' ' THR . 1.6 t-80 -58.48 -40.95 84.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.049 -1.432 . . . . 0.0 113.798 -173.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 98.21 119.29 4.01 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -174.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 558' ' ' GLU . 1.0 OUTLIER -92.75 152.48 19.46 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 173.431 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.2 t -73.05 165.09 25.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -37.54 74.49 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.451 -0.781 . . . . 0.0 111.385 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -75.61 -53.21 8.95 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 124.532 1.145 . . . . 0.0 110.648 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' GLU . . . . . 0.633 ' O ' HD22 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -58.75 -40.43 83.82 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 118.96 0.8 . . . . 0.0 111.17 177.689 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -59.53 -33.61 71.6 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.138 1.335 . . . . 0.0 109.794 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 19.1 mt -72.36 -37.15 68.87 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 116.715 -1.612 . . . . 0.0 110.068 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.77 -41.1 43.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.841 1.655 . . . . 0.0 109.431 174.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 554' ' ' LEU . 0.8 OUTLIER -68.86 -38.35 79.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.949 -177.801 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -47.25 74.19 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 119.512 1.051 . . . . 0.0 109.018 173.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -52.55 63.51 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.412 HD22 ' HG3' ' A' ' 551' ' ' GLN . 7.1 tt -55.43 -36.44 66.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.284 1.434 . . . . 0.0 111.288 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -61.21 -39.76 91.45 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.155 -1.591 . . . . 0.0 111.474 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -78.41 -25.05 45.98 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.857 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -66.99 -38.95 86.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.558 1.143 . . . . 0.0 109.503 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 17.0 mt -84.02 -9.92 58.28 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.882 1.273 . . . . 0.0 112.683 173.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 47.04 42.68 13.02 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.082 1.753 . . . . 0.0 114.577 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -143.75 127.16 16.83 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.865 -1.147 . . . . 0.0 109.819 178.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 32.5 mttp . . . . . 0 N--CA 1.471 0.603 0 C-N-CA 125.329 1.452 . . . . 0.0 110.288 177.169 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.106 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 -150.92 -67.7 0.19 Allowed 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 173.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 30.7 m -90.8 89.47 7.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 15.2 t -145.18 61.86 1.3 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.914 1.686 . . . . 0.0 108.3 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' MET . . . . . 0.728 ' HE1' HD12 ' A' ' 482' ' ' LEU . 53.2 tpp 46.29 51.65 11.22 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.711 1.72 . . . . 0.0 110.721 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.01 -51.29 0.23 Allowed 'General case' 0 CA--C 1.486 -1.491 0 CA-C-O 117.007 -1.473 . . . . 0.0 108.848 -175.159 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 453' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 534' ' ' THR . 7.4 mm -58.74 -52.6 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 124.946 1.404 . . . . 0.0 107.709 176.106 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 454' ' ' LEU . . . . . 0.435 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 2.7 mt -56.78 -47.13 80.87 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 118.74 0.7 . . . . 0.0 110.75 -175.149 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 455' ' ' ILE . . . . . 0.403 HG22 HD13 ' A' ' 519' ' ' LEU . 26.5 mt -62.22 -59.31 4.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 C-N-CA 123.851 0.86 . . . . 0.0 111.606 174.296 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.85 -38.14 96.04 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 120.833 1.651 . . . . 0.0 113.233 -173.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 457' ' ' LEU . . . . . 0.96 HD21 HG21 ' A' ' 525' ' ' ILE . 47.2 mt -68.9 -38.16 79.44 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.776 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 458' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 492' ' ' CYS . 2.6 tm? -65.96 -36.02 82.2 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.771 1.169 . . . . 0.0 109.86 173.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.7 t -60.91 -51.6 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 O-C-N 120.561 -1.337 . . . . 0.0 109.041 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.25 -20.24 55.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.719 0.807 . . . . 0.0 112.067 177.413 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 461' ' ' ASN . . . . . 0.512 ' HB3' HD12 ' A' ' 464' ' ' LEU . 9.7 t-20 -134.53 74.69 65.2 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 119.031 0.832 . . . . 0.0 109.316 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 462' ' ' PRO . . . . . 0.583 ' CB ' HD23 ' A' ' 498' ' ' LEU . 24.3 Cg_endo -68.31 -18.52 44.5 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.575 1.516 . . . . 0.0 112.119 -175.163 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -65.84 -15.06 62.55 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.693 1.197 . . . . 0.0 110.857 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 535' ' ' PHE . 43.1 mt -70.31 -12.28 61.48 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 120.437 -1.415 . . . . 0.0 109.01 173.509 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 465' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -58.82 -44.73 90.93 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.944 0.793 . . . . 0.0 109.195 173.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.6 m -70.3 -24.73 63.08 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.642 -1.286 . . . . 0.0 112.979 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.2 mt -83.92 -6.02 59.33 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.222 1.809 . . . . 0.0 111.393 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' VAL . . . . . 0.644 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.6 OUTLIER -93.82 157.87 37.38 Favored Pre-proline 0 CA--C 1.547 0.854 0 CA-C-N 121.041 1.746 . . . . 0.0 107.062 177.867 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 469' ' ' PRO . . . . . 0.644 ' HD2' HG22 ' A' ' 468' ' ' VAL . 19.1 Cg_endo -74.69 174.68 12.25 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.199 2.599 . . . . 0.0 111.076 173.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.58 8.73 2.14 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 124.777 3.651 . . . . 0.0 114.215 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' LEU . . . . . 0.875 HD12 HD21 ' A' ' 482' ' ' LEU . 2.2 mm? 63.69 55.22 1.72 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 129.367 3.067 . . . . 0.0 111.919 178.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.22 -39.71 11.39 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.699 0.8 . . . . 0.0 112.383 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -84.22 6.9 20.92 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 120.687 -1.258 . . . . 0.0 113.851 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -128.66 -71.41 0.64 Allowed 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 125.569 1.547 . . . . 0.0 109.622 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 6.5 t70 60.71 162.61 0.06 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-O 122.909 1.338 . . . . 0.0 112.311 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -74.81 -14.63 60.71 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 120.569 -1.332 . . . . 0.0 111.107 178.24 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -63.28 -42.39 99.09 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.766 1.226 . . . . 0.0 109.752 174.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -49.4 22.15 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 118.941 -1.104 . . . . 0.0 108.328 -176.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' LEU . . . . . 1.007 HD23 HD13 ' A' ' 482' ' ' LEU . 0.1 OUTLIER -117.2 118.12 36.11 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.56 -173.778 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -72.3 -2.08 11.14 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.266 1.978 . . . . 0.0 112.614 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -107.0 -7.55 33.01 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.831 1.205 . . . . 0.0 110.621 173.939 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' LEU . . . . . 1.007 HD13 HD23 ' A' ' 479' ' ' LEU . 2.9 tp -63.12 -32.69 74.13 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 116.441 -1.742 . . . . 0.0 108.742 177.883 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -52.4 -48.13 55.16 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 124.392 1.058 . . . . 0.0 110.775 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -44.32 97.0 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 121.547 -0.972 . . . . 0.0 111.928 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 485' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 32.8 t80 -66.19 -42.53 88.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.271 0.628 . . . . 0.0 110.984 177.558 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -64.64 -48.21 75.67 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 116.679 -1.629 . . . . 0.0 107.254 -176.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.25 -44.2 97.08 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 125.497 1.519 . . . . 0.0 109.886 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.508 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -55.47 -53.43 56.38 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.258 0.623 . . . . 0.0 111.005 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 489' ' ' VAL . . . . . 0.608 HG11 HG11 ' A' ' 468' ' ' VAL . 48.4 t -60.59 -46.78 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 116.214 -1.851 . . . . 0.0 110.361 174.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.03 -45.9 82.78 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 121.938 2.154 . . . . 0.0 110.361 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.8 m -62.34 -47.44 84.19 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 126.469 1.908 . . . . 0.0 109.2 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' CYS . . . . . 0.539 ' SG ' HD11 ' A' ' 458' ' ' LEU . 90.7 m -60.28 -38.58 84.03 Favored 'General case' 0 CA--C 1.555 1.152 0 CA-C-N 119.182 0.901 . . . . 0.0 111.854 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 493' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 465' ' ' ALA . 0.7 OUTLIER -60.33 -21.26 61.83 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 129.058 2.943 . . . . 0.0 111.517 175.192 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 23.5 t -89.45 -64.82 1.09 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -57.2 98.4 0.15 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 125.437 1.495 . . . . 0.0 114.124 -173.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -70.48 127.85 14.58 Favored 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.155 1.903 . . . . 0.0 109.963 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 59.77 42.89 98.23 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 498' ' ' LEU . . . . . 0.583 HD23 ' CB ' ' A' ' 462' ' ' PRO . 10.9 tp -56.26 159.53 3.47 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.398 1.094 . . . . 0.0 109.009 174.85 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 499' ' ' THR . . . . . 0.43 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 0.2 OUTLIER -125.4 163.48 22.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 177.772 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.3 m -53.02 -44.5 67.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.781 1.232 . . . . 0.0 109.514 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -73.58 -41.91 42.08 Favored Glycine 0 N--CA 1.442 -0.911 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.43 ' HB3' ' H ' ' A' ' 499' ' ' THR . 4.1 tp-100 -58.93 -31.38 68.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 124.626 1.17 . . . . 0.0 111.849 -176.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 35.4 tp -64.64 -57.35 9.29 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 174.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' LEU . . . . . 0.55 HD21 ' HA ' ' A' ' 517' ' ' GLU . 7.9 mp -59.36 -33.17 70.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.236 0.471 . . . . 0.0 112.062 179.479 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.04 -48.46 65.57 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.497 1.119 . . . . 0.0 109.805 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -63.29 -16.48 60.43 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.734 0.813 . . . . 0.0 112.417 176.957 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -111.94 16.18 20.43 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.269 1.827 . . . . 0.0 108.969 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -54.86 124.51 16.83 Favored 'General case' 0 C--O 1.227 -0.109 0 O-C-N 120.287 -1.508 . . . . 0.0 108.749 -177.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.77 37.48 61.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.821 -0.433 . . . . 0.0 112.03 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' THR . . . . . 0.826 HG22 ' H ' ' A' ' 512' ' ' ASN . 28.9 m -108.61 152.78 24.32 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.781 1.232 . . . . 0.0 108.737 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -59.75 -25.58 64.98 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.369 1.068 . . . . 0.0 110.591 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 512' ' ' ASN . . . . . 0.826 ' H ' HG22 ' A' ' 510' ' ' THR . 9.7 m120 -92.31 -17.47 24.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 116.02 -1.943 . . . . 0.0 110.181 178.712 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.99 59.3 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 120.016 1.28 . . . . 0.0 109.476 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.25 -45.71 83.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.891 0.769 . . . . 0.0 112.701 -179.171 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 31.1 m -66.93 -44.05 81.67 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.709 -0.62 . . . . 0.0 109.696 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' LEU . . . . . 0.508 HD21 HD11 ' A' ' 488' ' ' LEU . 61.8 mt -59.76 -40.15 87.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.539 1.536 . . . . 0.0 111.607 177.494 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.55 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.3 tt0 -68.49 -42.76 78.19 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 127.019 2.128 . . . . 0.0 109.216 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -61.43 -36.4 80.26 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.525 -0.734 . . . . 0.0 109.625 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 32.0 mt -82.37 -8.87 59.63 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.978 0.911 . . . . 0.0 112.246 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.9 t -77.5 -56.66 4.35 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 124.956 1.303 . . . . 0.0 108.14 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.8 12.85 1.18 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.947 1.299 . . . . 0.0 113.274 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 522' ' ' TRP . . . . . 0.421 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.9 t90 -68.53 128.44 36.63 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.189 -0.944 . . . . 0.0 110.903 -175.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.66 14.89 15.48 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.711 2.405 . . . . 0.0 110.043 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -65.99 -29.5 69.89 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 120.237 -1.54 . . . . 0.0 109.853 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 525' ' ' ILE . . . . . 0.96 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -107.63 -48.85 8.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 C-N-CA 128.441 2.696 . . . . 0.0 110.363 -179.744 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.81 34.28 0.41 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.253 2.221 . . . . 0.0 112.576 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -157.93 165.68 34.56 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.821 1.649 . . . . 0.0 108.155 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -114.56 -35.58 4.85 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.508 1.523 . . . . 0.0 109.365 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.25 -50.76 64.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.596 0.758 . . . . 0.0 110.051 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 2.3 mm -62.91 -28.5 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.615 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.44 -61.83 2.21 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 119.962 1.255 . . . . 0.0 109.111 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -54.46 -42.55 70.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.865 1.211 . . . . 0.0 110.612 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.05 -55.03 37.44 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 122.691 0.397 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 534' ' ' THR . . . . . 0.508 HG22 HG21 ' A' ' 453' ' ' ILE . 47.8 m -63.47 -31.71 72.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 117.414 -1.279 . . . . 0.0 109.102 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 535' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 464' ' ' LEU . 34.8 t80 -63.16 -54.71 33.45 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.09 1.768 . . . . 0.0 107.676 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 90.8 m -59.84 -48.28 82.32 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.525 0.73 . . . . 0.0 109.551 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -58.22 -46.23 86.26 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.992 1.717 . . . . 0.0 111.666 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 13.2 t -69.12 -45.42 70.2 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 126.824 2.05 . . . . 0.0 111.723 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.5 tt -59.76 -47.26 86.37 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 120.098 1.317 . . . . 0.0 110.753 173.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -59.07 -40.06 84.02 Favored 'General case' 0 C--O 1.207 -1.177 0 O-C-N 120.772 -1.205 . . . . 0.0 113.085 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -64.36 -44.29 91.91 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -52.9 63.67 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 543' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 474' ' ' LEU . 2.9 m-85 -62.29 -40.59 96.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.304 1.041 . . . . 0.0 109.523 -175.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -62.21 -53.81 49.95 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.7 t -51.0 -46.33 61.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.404 1.482 . . . . 0.0 110.817 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.753 HD21 HD11 ' A' ' 479' ' ' LEU . 80.0 mt -69.01 -39.93 79.0 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 119.399 0.999 . . . . 0.0 111.121 -177.423 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.416 ' HB3' HD11 ' A' ' 578' ' ' LEU . 20.2 mt -66.31 -37.29 85.04 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.997 -1.478 . . . . 0.0 110.255 174.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.29 -56.32 13.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.789 2.036 . . . . 0.0 107.818 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 15.6 mt -59.34 -47.1 86.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.66 1.584 . . . . 0.0 108.244 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -47.13 72.54 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 551' ' ' GLN . . . . . 0.461 ' HG3' HD12 ' A' ' 571' ' ' LEU . 27.8 tt0 -50.84 -55.75 15.48 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-O 114.097 -2.859 . . . . 0.0 107.798 175.066 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.08 -44.31 91.87 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 125.811 1.944 . . . . 0.0 110.21 -174.231 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -48.31 74.05 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.71 1.204 . . . . 0.0 109.61 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 554' ' ' LEU . . . . . 1.003 HD11 HD21 ' A' ' 571' ' ' LEU 0.252 0.2 OUTLIER -66.06 -44.33 84.83 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.818 -1.176 . . . . 0.0 109.207 176.236 . . . . . . . . 4 4 . 1 . 020 nuclear build full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.3 mm -64.25 -38.58 82.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 120.567 1.531 . . . . 0.0 108.334 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.28 -38.73 66.2 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.657 1.983 . . . . 0.0 107.624 174.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -2.15 1.85 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 116.659 -1.639 . . . . 0.0 112.582 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 558' ' ' GLU . . . . . 0.55 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.5 OUTLIER -82.92 -27.24 30.76 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.625 1.557 . . . . 0.0 111.338 173.091 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -107.44 -30.28 8.76 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.642 1.11 . . . . 0.0 111.27 -177.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.8 p -77.22 -51.6 10.66 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -114.3 -36.66 4.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.224 1.41 . . . . 0.0 111.829 -176.619 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 102.96 128.4 6.36 Favored Glycine 0 C--N 1.339 0.727 0 C-N-CA 125.574 1.559 . . . . 0.0 110.124 -173.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 563' ' ' LEU . . . . . 0.55 HD12 ' HB2' ' A' ' 558' ' ' GLU . 5.0 mt -87.4 153.23 21.6 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 173.402 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.75 168.52 11.24 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.282 178.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -58.14 -41.45 83.74 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -76.08 -53.61 8.08 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 123.276 0.63 . . . . 0.0 109.786 -178.006 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' GLU . . . . . 0.465 ' HB3' HD22 ' A' ' 563' ' ' LEU . 8.5 mt-10 -60.78 -36.07 78.06 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.907 -177.542 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -59.56 -39.08 82.87 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 120.094 1.315 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 1.5 mp -74.94 -38.24 61.8 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 117.531 -1.223 . . . . 0.0 111.99 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -47.52 -40.8 19.57 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 120.244 1.384 . . . . 0.0 107.875 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' LEU . . . . . 1.003 HD21 HD11 ' A' ' 554' ' ' LEU . 4.5 mm? -72.12 -34.93 68.96 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 115.971 -1.966 . . . . 0.0 110.978 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -48.29 75.82 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 121.109 1.777 . . . . 0.0 107.886 173.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -26.27 68.22 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 578' ' ' LEU . 8.0 tt -81.72 -34.08 30.76 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.556 1.542 . . . . 0.0 109.865 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.67 -44.78 92.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.82 1.648 . . . . 0.0 109.317 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -30.09 68.1 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.72 -35.2 67.5 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.429 -174.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.508 HD12 HD23 ' A' ' 574' ' ' LEU . 13.9 mt -81.54 -22.31 37.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.39 1.476 . . . . 0.0 112.891 173.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 50.83 81.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 128.996 2.918 . . . . 0.0 115.494 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -78.03 108.43 11.3 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.909 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 5.3 tptt . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 130.62 3.568 . . . . 0.0 111.593 173.463 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.538 0.488 0 N-CA-C 111.35 0.129 . . . . 0.0 111.35 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . 0.477 ' HB3' ' CH2' ' A' ' 522' ' ' TRP . 16.4 mtt180 -86.27 -50.63 6.81 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 120.234 -1.541 . . . . 0.0 109.362 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 16.0 mm -63.15 -52.45 58.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.1 -42.43 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.486 1.039 . . . . 0.0 111.656 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 68.5 mt -72.96 -58.61 4.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 CA-C-N 118.719 0.691 . . . . 0.0 110.264 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.21 -32.65 60.36 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.344 0.973 . . . . 0.0 112.383 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 531' ' ' ALA . 64.9 mt -69.14 -49.55 55.93 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 117.527 0.663 . . . . 0.0 109.664 173.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.63 -38.43 75.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.67 0.788 . . . . 0.0 111.346 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.31 -55.43 24.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.069 1.348 . . . . 0.0 109.241 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . 0.587 ' HA ' HG23 ' A' ' 500' ' ' THR . 2.4 mp0 -70.06 -20.82 63.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 118.823 -0.608 . . . . 0.0 112.43 -178.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -141.58 80.07 16.5 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.712 1.605 . . . . 0.0 110.369 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.81 -15.34 40.51 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.467 1.445 . . . . 0.0 112.897 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -68.14 -18.94 64.76 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.824 1.193 . . . . 0.0 110.214 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 535' ' ' PHE . 79.6 mt -63.48 -13.37 39.99 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 121.33 -0.856 . . . . 0.0 110.827 173.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.03 -26.48 68.29 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 118.789 0.722 . . . . 0.0 111.115 173.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 90.6 m -82.92 -17.48 43.51 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.595 1.089 . . . . 0.0 110.854 174.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.73 -8.34 50.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.112 0.965 . . . . 0.0 111.375 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 489' ' ' VAL . 9.9 p -88.47 145.47 35.58 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-N 119.82 1.191 . . . . 0.0 108.488 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.01 170.98 13.17 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.566 2.844 . . . . 0.0 111.484 174.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.09 13.95 0.59 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.467 3.445 . . . . 0.0 113.933 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.627 ' HA ' HD13 ' A' ' 474' ' ' LEU . 9.6 mp 64.05 18.35 11.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.645 1.978 . . . . 0.0 115.935 173.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -47.1 -42.22 18.66 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.712 1.605 . . . . 0.0 114.78 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.26 6.59 48.63 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.908 0.883 . . . . 0.0 112.633 -175.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.797 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.2 mp -115.06 -71.83 0.72 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.662 1.585 . . . . 0.0 108.595 -173.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 16.5 t70 59.97 166.9 0.07 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 123.256 1.503 . . . . 0.0 110.118 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.3 -6.19 59.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 119.688 -1.882 . . . . 0.0 110.605 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -81.91 -44.85 16.26 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.72 1.608 . . . . 0.0 112.021 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -76.36 -21.2 56.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 119.072 -0.489 . . . . 0.0 111.662 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 52.9 mt -125.27 96.5 39.17 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-O 118.141 -0.933 . . . . 0.0 108.692 -178.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.46 78.11 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.792 2.995 . . . . 0.0 111.197 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.96 -17.06 2.37 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.875 2.179 . . . . 0.0 113.834 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 11.6 tp -56.24 -27.43 54.96 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.615 2.207 . . . . 0.0 110.231 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.05 -36.77 9.38 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 118.998 -0.89 . . . . 0.0 112.816 174.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -47.44 81.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.752 1.776 . . . . 0.0 110.276 175.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -59.74 -49.99 75.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.376 1.07 . . . . 0.0 110.658 174.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -61.77 -45.88 91.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.439 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -57.46 -52.84 63.77 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.782 HD11 HD21 ' A' ' 516' ' ' LEU . 0.0 OUTLIER -55.69 -48.66 74.73 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.851 0.46 . . . . 0.0 112.028 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 468' ' ' VAL . 75.3 t -58.79 -49.88 81.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -58.06 -46.37 85.52 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.928 1.291 . . . . 0.0 109.942 -175.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.7 m -62.81 -41.51 99.33 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 126.499 1.92 . . . . 0.0 110.785 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 44.3 m -62.14 -45.35 93.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.388 1.449 . . . . 0.0 110.38 176.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -23.91 67.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.983 0.913 . . . . 0.0 112.253 174.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -15.29 53.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.618 1.167 . . . . 0.0 111.535 176.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.9 75.82 66.16 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 124.984 1.314 . . . . 0.0 108.776 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.41 121.39 9.35 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.021 1.814 . . . . 0.0 109.474 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 98.47 8.24 54.97 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.375 0.988 . . . . 0.0 113.421 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.01 152.55 36.57 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.435 1.118 . . . . 0.0 108.027 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 7.3 p -134.03 169.53 17.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.151 0.98 . . . . 0.0 109.031 -174.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.587 HG23 ' HA ' ' A' ' 460' ' ' GLN . 5.1 m -49.88 -48.33 51.47 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.607 1.563 . . . . 0.0 111.509 174.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -82.94 -41.45 8.69 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -174.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 51.4 tp60 -63.6 -24.84 67.97 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.449 1.1 . . . . 0.0 111.296 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 68.4 tp -55.58 -50.3 70.45 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.676 1.19 . . . . 0.0 110.451 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.61 -35.06 79.77 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . 0.563 ' OE1' ' HD3' ' A' ' 508' ' ' ARG . 1.0 OUTLIER -70.98 -31.59 68.18 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 117.85 0.295 . . . . 0.0 110.217 178.541 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -70.12 -20.71 63.16 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -112.57 17.22 19.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.034 1.733 . . . . 0.0 109.751 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . 0.563 ' HD3' ' OE1' ' A' ' 505' ' ' GLU . 6.6 tpt180 -55.13 120.36 6.86 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.785 -1.197 . . . . 0.0 109.98 -174.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.43 18.25 78.13 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 118.641 -1.088 . . . . 0.0 113.542 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.827 HG22 ' H ' ' A' ' 512' ' ' ASN . 30.0 m -92.79 150.59 20.53 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.545 1.672 . . . . 0.0 107.998 -175.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -57.72 -20.83 37.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.897 0.856 . . . . 0.0 112.385 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.827 ' H ' HG22 ' A' ' 510' ' ' THR . 11.6 m-20 -93.39 -17.91 22.97 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.819 1.247 . . . . 0.0 109.703 -177.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -54.29 -38.44 65.91 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.208 1.403 . . . . 0.0 110.971 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.1 88.74 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.822 1.192 . . . . 0.0 111.868 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 32.1 m -65.63 -43.16 90.35 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.679 0.792 . . . . 0.0 109.712 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.782 HD21 HD11 ' A' ' 488' ' ' LEU . 13.1 mt -66.7 -32.78 74.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.276 0.631 . . . . 0.0 112.09 179.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.19 -44.52 96.42 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.84 1.656 . . . . 0.0 108.413 174.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.37 -37.38 83.16 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 123.714 0.805 . . . . 0.0 109.899 -177.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.35 -31.04 38.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.89 1.676 . . . . 0.0 114.277 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.4 t -70.33 -53.85 14.99 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 124.989 1.315 . . . . 0.0 110.53 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -71.24 9.73 0.71 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.782 1.633 . . . . 0.0 114.03 175.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.477 ' CH2' ' HB3' ' A' ' 452' ' ' ARG . 0.8 OUTLIER -78.33 85.61 4.45 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.925 1.29 . . . . 0.0 113.512 -173.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -2.63 1.25 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.632 1.973 . . . . 0.0 112.998 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.78 -0.93 10.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.514 1.526 . . . . 0.0 112.503 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -150.17 -63.14 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 127.463 2.305 . . . . 0.0 109.869 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.62 21.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.272 2.629 . . . . 0.0 116.97 173.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -116.75 177.36 4.73 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.5 1.12 . . . . 0.0 110.041 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -135.11 -30.11 1.07 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 126.775 2.03 . . . . 0.0 112.011 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -81.81 -56.28 4.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.319 1.447 . . . . 0.0 109.167 174.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.51 -28.23 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.799 1.24 . . . . 0.0 108.179 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.44 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -53.88 -50.63 65.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.002 0.819 . . . . 0.0 111.718 177.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.53 -49.95 67.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.829 0.74 . . . . 0.0 109.692 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -48.81 73.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.692 0.797 . . . . 0.0 110.916 177.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.1 m -66.23 -32.42 73.83 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 118.161 -0.923 . . . . 0.0 109.083 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.408 ' CD1' HD13 ' A' ' 464' ' ' LEU . 37.9 t80 -63.78 -54.1 40.5 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 120.519 1.509 . . . . 0.0 108.906 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 29.8 m -58.89 -45.97 88.97 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.385 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.57 -41.68 98.38 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.974 1.261 . . . . 0.0 112.165 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.6 t -64.21 -49.84 70.42 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.68 1.992 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 3.7 tt -55.51 -50.04 71.01 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 124.65 1.18 . . . . 0.0 108.002 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -55.69 -44.61 77.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.814 0.846 . . . . 0.0 108.812 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -61.84 -44.47 96.76 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.192 0.905 . . . . 0.0 110.538 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -51.26 70.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.326 -0.858 . . . . 0.0 108.736 178.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.797 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.8 m-85 -59.96 -49.33 78.09 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 123.823 0.849 . . . . 0.0 109.883 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -50.39 -52.11 40.31 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.481 2.312 . . . . 0.0 110.092 177.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -44.19 91.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.547 1.139 . . . . 0.0 112.132 176.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.37 -39.6 92.51 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 120.888 -1.133 . . . . 0.0 111.355 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 23.9 mt -67.49 -38.72 84.76 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.229 1.412 . . . . 0.0 108.891 176.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.25 -51.19 69.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.621 1.568 . . . . 0.0 109.44 174.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.94 -47.78 81.89 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.91 -45.13 93.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 117.742 -1.123 . . . . 0.0 109.73 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -52.89 56.14 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.393 1.077 . . . . 0.0 109.853 175.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -36.03 82.82 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.166 -177.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -62.03 -43.98 97.68 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 111.491 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.443 ' HB3' HD11 ' A' ' 571' ' ' LEU . 12.2 mt -63.06 -55.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.944 1.298 . . . . 0.0 108.485 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.06 -37.26 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.8 66.87 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 120.084 -1.635 . . . . 0.0 111.659 174.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -96.22 0.01 50.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 116.629 -1.653 . . . . 0.0 112.476 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.59 -44.72 11.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 121.406 1.912 . . . . 0.0 110.617 174.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 1.1 11.74 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.053 1.341 . . . . 0.0 113.471 -173.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 561' ' ' HIS . 5.1 t -139.73 -88.74 0.19 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -178.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.696 ' H ' HG23 ' A' ' 560' ' ' THR . 0.7 OUTLIER -50.67 -49.64 56.76 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.767 0.827 . . . . 0.0 111.831 -176.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.79 87.79 1.38 Allowed Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 107.341 -2.304 . . . . 0.0 107.341 -175.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 163.27 10.59 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 173.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 32.3 p -67.37 170.13 7.84 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.431 -0.793 . . . . 0.0 111.737 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -64.21 -38.08 89.79 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -64.02 -49.66 71.53 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 124.829 1.252 . . . . 0.0 108.624 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.09 -37.22 84.24 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.816 1.644 . . . . 0.0 110.637 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.648 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.2 OUTLIER -66.98 -30.1 70.13 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.311 1.445 . . . . 0.0 112.541 174.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 13.5 mt -78.86 -38.68 37.27 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-O 117.529 -1.224 . . . . 0.0 109.286 173.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -53.27 -42.35 66.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 119.508 1.049 . . . . 0.0 108.463 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 568' ' ' ARG . 10.4 mt -53.09 -44.77 67.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.714 1.206 . . . . 0.0 112.736 173.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -52.13 67.01 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 120.113 1.324 . . . . 0.0 109.182 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.41 -45.26 92.0 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.886 0.742 . . . . 0.0 109.861 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 4.3 tp -61.17 -39.16 89.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.998 1.319 . . . . 0.0 111.215 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -65.77 -36.39 83.42 Favored 'General case' 0 C--O 1.227 -0.097 0 C-N-CA 123.864 0.866 . . . . 0.0 109.659 177.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -67.91 -38.46 82.97 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 110.664 176.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.27 -36.42 82.93 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.756 0.822 . . . . 0.0 110.273 176.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.0 mt . . . . . 0 N--CA 1.454 -0.227 0 C-N-CA 123.902 0.881 . . . . 0.0 109.762 -177.415 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.474 0.736 0 CA-C-O 122.215 1.007 . . . . 0.0 112.138 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -64.93 -26.41 68.3 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-O 116.066 -1.921 . . . . 0.0 110.112 175.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.457 HD13 ' CH2' ' A' ' 522' ' ' TRP . 15.8 mm -66.6 -52.87 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 O-C-N 125.494 1.746 . . . . 0.0 108.33 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.508 HD23 ' CE1' ' A' ' 535' ' ' PHE . 12.5 mt -52.97 -45.25 67.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.662 1.119 . . . . 0.0 111.73 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.559 HD13 HD12 ' A' ' 484' ' ' LEU . 41.5 mt -71.55 -60.82 2.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-O 118.128 -0.939 . . . . 0.0 111.337 177.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -48.6 -43.51 28.67 Favored Glycine 0 C--O 1.227 -0.344 0 C-N-CA 126.088 1.804 . . . . 0.0 112.841 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.999 HD21 HG21 ' A' ' 525' ' ' ILE . 55.1 mt -66.25 -42.4 88.63 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 116.282 -1.818 . . . . 0.0 108.525 173.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.521 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.9 tm? -65.17 -28.62 69.52 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 120.89 1.677 . . . . 0.0 111.502 176.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 455' ' ' ILE . 31.4 t -66.66 -55.17 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -81.57 -11.52 59.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.015 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.793 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.1 OUTLIER -130.5 74.76 79.89 Favored Pre-proline 0 N--CA 1.447 -0.591 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . 0.723 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.6 Cg_endo -65.01 -18.79 63.05 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 120.979 1.119 . . . . 0.0 112.197 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.18 -19.71 62.37 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.261 -0.899 . . . . 0.0 111.211 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' A' ' 461' ' ' ASN . 17.2 mt -69.79 -13.58 62.35 Favored 'General case' 0 N--CA 1.461 0.075 0 CA-C-N 118.593 0.633 . . . . 0.0 111.169 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.58 -32.84 72.96 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 117.579 0.172 . . . . 0.0 110.965 174.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.3 m -79.04 -21.17 47.25 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.469 -0.769 . . . . 0.0 111.693 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 464' ' ' LEU . 0.5 OUTLIER -81.75 -19.26 41.73 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 121.513 -0.742 . . . . 0.0 110.297 174.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 489' ' ' VAL . 2.2 p -64.31 147.57 96.93 Favored Pre-proline 0 N--CA 1.444 -0.749 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -178.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.2 Cg_endo -74.5 172.77 15.49 Favored 'Trans proline' 0 N--CA 1.434 -1.985 0 C-N-CA 121.492 1.461 . . . . 0.0 109.829 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -75.42 4.4 4.98 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 124.172 3.248 . . . . 0.0 112.475 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.547 ' CD2' HD11 ' A' ' 482' ' ' LEU . 3.9 mp 66.21 68.58 0.44 Allowed 'General case' 0 C--N 1.348 0.537 0 C-N-CA 124.136 0.975 . . . . 0.0 109.132 177.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.98 -70.53 0.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.92 0.866 . . . . 0.0 110.215 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.64 31.17 5.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.732 0.813 . . . . 0.0 109.375 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.605 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.2 OUTLIER -90.26 -89.15 0.16 Allowed 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -177.364 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.7 t70 64.19 158.44 0.09 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.417 1.58 . . . . 0.0 110.324 -178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.493 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 18.1 mt-10 -81.84 -16.26 51.36 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 120.4 -1.438 . . . . 0.0 109.094 173.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.76 -19.93 66.08 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 123.095 1.426 . . . . 0.0 112.801 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -101.27 -26.04 13.77 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 113.977 -1.465 . . . . 0.0 111.447 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 9.5 mt -142.52 116.11 6.38 Favored Pre-proline 0 N--CA 1.442 -0.832 0 O-C-N 124.127 0.892 . . . . 0.0 110.213 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.1 -44.2 13.15 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.269 1.979 . . . . 0.0 109.791 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -79.15 -20.91 68.81 Favored Glycine 0 C--N 1.339 0.697 0 O-C-N 120.396 -1.44 . . . . 0.0 112.117 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.547 HD11 ' CD2' ' A' ' 471' ' ' LEU . 1.9 tm? -55.14 -37.2 66.65 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 118.003 0.902 . . . . 0.0 110.203 174.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.493 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -51.17 -47.07 50.63 Favored Glycine 0 C--O 1.221 -0.709 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.33 175.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.676 HD13 HD12 ' A' ' 488' ' ' LEU . 1.2 tm? -52.06 -51.97 54.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.039 1.42 . . . . 0.0 111.639 176.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.48 ' CZ ' HD22 ' A' ' 454' ' ' LEU . 24.8 t80 -55.84 -51.9 65.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.812 0.845 . . . . 0.0 110.382 175.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.434 HH21 ' CG ' ' A' ' 490' ' ' ASN . 0.0 OUTLIER -59.88 -46.26 89.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.178 0.591 . . . . 0.0 111.372 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -63.2 -47.83 80.88 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 127.026 2.13 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.941 HD11 HD21 ' A' ' 516' ' ' LEU . 0.4 OUTLIER -57.06 -46.12 82.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.257 176.182 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 468' ' ' VAL . 72.1 t -63.48 -41.95 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 CA-C-O 117.069 -1.443 . . . . 0.0 108.708 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . 0.434 ' CG ' HH21 ' A' ' 486' ' ' ARG . 27.1 t-20 -54.43 -43.03 71.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 120.95 1.704 . . . . 0.0 110.779 -177.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 17.7 m -70.13 -48.35 57.84 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.803 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.538 ' SG ' HD22 ' A' ' 498' ' ' LEU . 72.7 m -59.46 -36.07 75.28 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 118.993 0.815 . . . . 0.0 111.662 177.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.663 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.3 OUTLIER -60.73 -15.19 26.69 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 128.115 2.566 . . . . 0.0 111.583 174.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.3 t -95.57 -57.74 2.3 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-O 116.59 -1.671 . . . . 0.0 108.087 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.448 ' CB ' HD13 ' A' ' 498' ' ' LEU . 27.7 mm100 -57.91 104.24 0.41 Allowed Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.662 1.585 . . . . 0.0 110.469 -175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -79.24 122.68 5.28 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 123.01 2.474 . . . . 0.0 111.318 -174.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 67.3 33.15 81.59 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 118.623 -1.751 . . . . 0.0 112.71 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 462' ' ' PRO . 2.9 tp -64.42 148.49 50.39 Favored 'General case' 0 CA--C 1.506 -0.744 0 O-C-N 120.939 -1.33 . . . . 0.0 111.346 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . 0.444 ' N ' ' HG ' ' A' ' 498' ' ' LEU . 1.1 p -112.05 169.16 9.04 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.96 1.704 . . . . 0.0 110.135 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.6 m -64.66 -35.51 81.26 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.12 -46.9 33.1 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 108.189 -1.964 . . . . 0.0 108.189 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -43.67 55.72 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.48 -173.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 28.5 tp -52.5 -54.89 26.5 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 118.63 0.65 . . . . 0.0 112.218 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.87 -34.84 65.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.941 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.11 -44.24 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 119.467 1.03 . . . . 0.0 112.23 175.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -68.54 -13.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.453 1.501 . . . . 0.0 111.146 176.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.657 ' CD2' HG21 ' A' ' 510' ' ' THR . 37.3 m-85 -118.36 18.56 13.63 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 125.425 1.49 . . . . 0.0 108.728 178.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -58.33 -20.49 43.72 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.795 1.634 . . . . 0.0 112.617 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -137.71 42.48 1.29 Allowed Glycine 0 N--CA 1.438 -1.172 0 C-N-CA 124.454 1.026 . . . . 0.0 111.141 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.781 HG22 ' H ' ' A' ' 512' ' ' ASN . 51.3 m -105.43 139.57 39.85 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.583 1.191 . . . . 0.0 109.041 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.03 -20.5 17.07 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 119.967 -1.708 . . . . 0.0 113.237 175.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.781 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m120 -94.53 -16.91 22.89 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 125.8 1.64 . . . . 0.0 112.173 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -43.88 -37.31 2.77 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 125.64 1.576 . . . . 0.0 110.589 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.79 -60.8 2.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.509 1.524 . . . . 0.0 110.392 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 51.5 m -61.93 -40.75 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.889 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' ' 488' ' ' LEU . 17.4 mt -60.7 -31.34 70.62 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 119.128 0.876 . . . . 0.0 111.171 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.06 -41.53 64.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 122.171 0.986 . . . . 0.0 110.987 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -34.72 78.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.179 174.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.43 HD13 HG22 ' A' ' 455' ' ' ILE . 92.1 mt -77.19 -8.86 58.27 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 116.525 -1.702 . . . . 0.0 112.195 174.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.5 t -76.16 -67.67 0.66 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.414 1.886 . . . . 0.0 109.264 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -2.07 8.36 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.536 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.4 t90 -49.37 136.67 15.64 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 123.02 0.528 . . . . 0.0 109.967 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.77 3.24 8.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 124.887 1.275 . . . . 0.0 108.457 -174.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -53.81 -37.78 63.9 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.515 1.15 . . . . 0.0 112.21 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.999 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -93.29 -55.71 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 113.308 -1.769 . . . . 0.0 109.027 179.421 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 45.95 40.07 6.38 Favored 'General case' 0 C--N 1.344 0.343 0 O-C-N 124.612 1.195 . . . . 0.0 110.838 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -159.47 153.21 22.92 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.94 -25.77 10.57 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.722 1.209 . . . . 0.0 111.388 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -82.43 -62.83 1.51 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 124.042 0.937 . . . . 0.0 109.617 177.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 80.1 mt -52.39 -32.89 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.748 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -49.11 -58.42 4.99 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.006 175.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -50.34 -42.52 53.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.411 1.459 . . . . 0.0 113.14 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -51.68 63.15 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.795 176.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . 0.43 HG22 HG21 ' A' ' 453' ' ' ILE . 17.0 m -61.72 -28.49 69.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.364 1.466 . . . . 0.0 110.031 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.624 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.0 t80 -69.08 -59.75 2.82 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 126.491 1.916 . . . . 0.0 109.816 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 35.3 m -61.18 -39.81 91.54 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 124.028 0.83 . . . . 0.0 109.259 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -56.86 -45.68 82.31 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.27 0.941 . . . . 0.0 110.195 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 3.6 t -65.18 -49.52 69.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.671 0.788 . . . . 0.0 111.461 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.461 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -55.4 -43.39 75.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.053 177.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.06 -41.21 96.18 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-O 116.166 -1.873 . . . . 0.0 107.46 176.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -68.73 -37.26 79.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 120.782 1.628 . . . . 0.0 109.569 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.8 ttp -62.58 -55.78 24.05 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.817 0.847 . . . . 0.0 110.413 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.697 ' HA ' HD12 ' A' ' 546' ' ' LEU . 6.3 m-85 -56.06 -45.52 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.367 1.867 . . . . 0.0 110.893 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -59.05 -48.96 79.7 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 126.214 1.806 . . . . 0.0 109.087 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . 0.422 ' O ' ' HG ' ' A' ' 549' ' ' LEU . 3.1 t -56.28 -45.66 80.05 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.5 mt -63.16 -46.61 86.37 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.998 -1.064 . . . . 0.0 110.495 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 28.4 mt -60.62 -37.81 82.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.826 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.74 -52.63 35.25 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.632 1.573 . . . . 0.0 109.613 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 545' ' ' SER . 14.6 mt -56.28 -45.47 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.309 1.044 . . . . 0.0 108.702 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 35.7 ttt85 -55.15 -54.83 38.32 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.963 175.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.4 -55.31 9.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.207 1.567 . . . . 0.0 109.306 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.56 -38.52 81.34 Favored 'General case' 0 N--CA 1.442 -0.858 0 O-C-N 123.71 0.631 . . . . 0.0 109.982 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.74 -40.17 87.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 119.05 0.841 . . . . 0.0 112.818 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.754 ' HB2' HD21 ' A' ' 571' ' ' LEU . 2.4 mt -66.8 -51.1 59.64 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.475 HD13 HD13 ' A' ' 571' ' ' LEU . 38.4 mm -64.9 -38.68 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 CA-C-O 122.976 1.369 . . . . 0.0 110.843 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.42 65.93 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 119.843 -1.786 . . . . 0.0 109.949 174.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -106.26 11.65 30.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 125.51 1.524 . . . . 0.0 110.732 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 563' ' ' LEU . 0.9 OUTLIER -98.93 -29.8 12.73 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.994 1.27 . . . . 0.0 110.641 177.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -22.23 17.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.075 -178.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -96.55 -68.88 0.78 Allowed 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.222 1.487 . . . . 0.0 108.14 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -43.69 18.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.352 178.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 79.68 79.33 0.84 Allowed Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.552 HD11 ' HB2' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -44.9 157.65 0.07 Allowed 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 125.563 1.545 . . . . 0.0 110.743 172.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.16 157.95 7.61 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.597 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.446 ' O ' HD23 ' A' ' 569' ' ' LEU . 1.8 m-20 -53.07 -43.23 66.56 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.466 175.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.39 -46.74 88.9 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.158 177.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -60.59 -35.43 76.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.3 0.571 . . . . 0.0 111.478 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.507 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -65.02 -37.71 88.53 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.444 -0.785 . . . . 0.0 111.648 175.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.446 HD23 ' O ' ' A' ' 565' ' ' ASN . 4.2 mm? -66.55 -41.07 89.25 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-O 117.454 -1.26 . . . . 0.0 109.024 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -50.91 -38.3 49.18 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.807 0.813 . . . . 0.0 110.966 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 554' ' ' LEU . 2.0 mt -63.07 -46.59 86.76 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 118.002 -0.999 . . . . 0.0 112.21 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -50.68 52.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.711 1.141 . . . . 0.0 108.981 173.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -33.89 73.5 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -176.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -39.79 64.93 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.65 1.58 . . . . 0.0 111.036 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -56.97 -45.46 82.87 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.905 0.882 . . . . 0.0 108.869 174.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -66.3 -31.63 72.55 Favored 'General case' 0 C--O 1.189 -2.093 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 175.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . 0.265 0.3 OUTLIER -68.87 -23.08 64.17 Favored 'General case' 0 CA--C 1.497 -1.084 0 C-N-CA 129.72 3.208 . . . . 0.0 115.06 174.336 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.503 -0.828 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 -174.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.54 0.569 0 CA-C-O 120.55 0.215 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.9 ttm180 -79.62 -30.47 41.43 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.515 -1.707 . . . . 0.0 109.836 -179.724 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.561 HG21 ' HB2' ' A' ' 538' ' ' SER . 18.5 mm -61.98 -42.47 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 119.92 1.236 . . . . 0.0 109.458 175.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.485 ' CD2' ' HE3' ' A' ' 542' ' ' MET . 4.2 mm? -60.85 -52.75 63.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.644 -173.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.583 HG23 HD13 ' A' ' 488' ' ' LEU . 23.0 mt -65.5 -50.37 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 C-N-CA 124.665 1.186 . . . . 0.0 108.123 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -53.59 -50.32 53.94 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 126.074 1.797 . . . . 0.0 113.344 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.785 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -69.48 -47.41 64.01 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.291 -0.955 . . . . 0.0 109.046 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 465' ' ' ALA . 3.2 tm? -59.83 -33.22 71.47 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.431 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 2.4 t -60.27 -52.32 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 126.149 1.78 . . . . 0.0 108.434 175.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -76.34 -23.61 54.22 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 122.891 0.476 . . . . 0.0 111.97 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.449 ' HB3' HD12 ' A' ' 464' ' ' LEU . 4.0 t30 -129.76 74.0 81.04 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 124.79 1.236 . . . . 0.0 110.097 -173.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -61.81 -19.5 65.75 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.282 1.988 . . . . 0.0 111.701 -174.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.87 -17.12 63.94 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.946 1.298 . . . . 0.0 111.607 173.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.566 HD22 ' CD2' ' A' ' 535' ' ' PHE . 19.1 mt -63.98 -13.43 46.25 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 120.113 -1.617 . . . . 0.0 109.965 173.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.557 ' HB1' HD23 ' A' ' 493' ' ' LEU . . . -65.23 -38.99 92.12 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 88.5 m -71.68 -18.26 62.19 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.001 1.273 . . . . 0.0 112.464 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.1 mt -87.93 -22.13 24.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.578 1.151 . . . . 0.0 112.29 173.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.696 ' CG1' HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -80.08 146.85 64.09 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.469 ' O ' HD12 ' A' ' 471' ' ' LEU . 23.9 Cg_endo -75.43 174.23 13.15 Favored 'Trans proline' 0 CA--C 1.553 1.426 0 C-N-CA 122.384 2.056 . . . . 0.0 111.494 174.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 469' ' ' PRO . 45.0 Cg_endo -69.34 4.37 2.05 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 125.115 3.877 . . . . 0.0 114.113 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 482' ' ' LEU . 5.5 mp 71.76 55.62 0.19 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.647 2.379 . . . . 0.0 112.442 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.86 -25.98 44.01 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 -178.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.29 2.08 10.27 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.714 1.206 . . . . 0.0 112.212 -176.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.454 HD21 ' CE1' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -88.38 -75.99 0.41 Allowed 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 126.008 1.723 . . . . 0.0 106.933 -173.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 9.9 t70 63.73 159.03 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 O-C-N 125.452 1.72 . . . . 0.0 112.542 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -93.77 -16.02 24.59 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 119.981 -1.7 . . . . 0.0 110.444 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.69 -22.38 43.49 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.286 2.235 . . . . 0.0 112.383 175.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -16.78 33.22 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 119.081 0.855 . . . . 0.0 111.664 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.44 103.92 6.53 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 123.397 0.679 . . . . 0.0 110.855 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.77 77.84 0.73 Allowed 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.603 3.536 . . . . 0.0 110.004 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.03 -11.08 3.09 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.866 1.698 . . . . 0.0 113.409 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.672 HD11 HD23 ' A' ' 471' ' ' LEU . 2.0 tm? -65.09 -34.31 78.11 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.434 1.617 . . . . 0.0 109.437 173.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.31 -38.47 12.71 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 119.254 0.933 . . . . 0.0 112.875 175.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 488' ' ' LEU . 0.5 OUTLIER -57.29 -55.05 39.74 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 117.791 0.796 . . . . 0.0 109.581 174.275 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -55.99 -47.43 77.72 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.728 0.811 . . . . 0.0 111.29 177.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -49.38 73.74 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.66 -38.76 80.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.738 1.215 . . . . 0.0 111.407 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.6 -49.72 76.68 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 125.688 1.595 . . . . 0.0 110.436 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.696 HG11 ' CG1' ' A' ' 468' ' ' VAL . 69.2 t -60.47 -49.94 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 CA-C-O 117.324 -1.322 . . . . 0.0 107.467 173.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -51.93 -45.48 64.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.121 1.328 . . . . 0.0 109.784 -175.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.9 m -64.1 -49.46 72.16 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 125.095 1.358 . . . . 0.0 110.45 173.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' A' ' 458' ' ' LEU . 98.9 m -58.18 -36.95 73.82 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.478 1.49 . . . . 0.0 113.216 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.557 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.5 OUTLIER -61.11 -21.68 63.93 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 130.044 3.338 . . . . 0.0 112.156 173.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.9 t -93.41 -61.72 1.51 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 174.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.422 ' HB3' HD13 ' A' ' 498' ' ' LEU . 63.8 mm-40 -48.91 91.88 0.04 OUTLIER Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 128.85 2.86 . . . . 0.0 112.206 -173.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -70.66 123.85 10.18 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.336 2.024 . . . . 0.0 111.345 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.07 37.72 94.92 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.441 HD21 HD13 ' A' ' 503' ' ' LEU . 22.6 tp -59.37 162.28 4.89 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.786 0.803 . . . . 0.0 110.187 175.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.75 164.32 29.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.024 1.33 . . . . 0.0 107.555 -176.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.7 m -52.37 -46.16 66.08 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.934 1.294 . . . . 0.0 110.268 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.24 -44.16 23.49 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.83 -26.9 68.98 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.011 0.925 . . . . 0.0 111.142 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.441 HD13 HD21 ' A' ' 498' ' ' LEU . 42.2 tp -60.6 -54.33 46.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.14 -32.72 73.35 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.711 0.805 . . . . 0.0 111.159 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.07 -44.31 80.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.574 1.15 . . . . 0.0 111.243 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -63.93 -18.27 64.06 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.245 1.818 . . . . 0.0 112.638 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.5 ' CD2' HD13 ' A' ' 516' ' ' LEU . 55.3 m-85 -113.13 18.57 17.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 127.29 2.236 . . . . 0.0 111.11 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.8 125.07 20.75 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.482 -1.386 . . . . 0.0 109.874 -176.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.65 37.55 61.69 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.769 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.4 m -108.44 151.48 26.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -61.29 -24.88 66.73 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.846 1.259 . . . . 0.0 110.678 173.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.769 ' H ' HG22 ' A' ' 510' ' ' THR . 10.2 m-80 -91.97 -16.91 25.89 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-O 116.979 -1.486 . . . . 0.0 109.909 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.98 -45.79 51.9 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-N 119.567 1.076 . . . . 0.0 108.661 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.47 -46.13 84.04 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 81.4 m -64.16 -47.59 79.27 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 118.504 -0.76 . . . . 0.0 109.244 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 488' ' ' LEU . 82.1 mt -58.39 -41.16 84.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.698 1.599 . . . . 0.0 110.79 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -41.79 74.43 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 127.155 2.182 . . . . 0.0 109.301 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -62.0 -41.11 97.7 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.373 -1.299 . . . . 0.0 108.533 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.402 HD13 HG22 ' A' ' 455' ' ' ILE . 92.8 mt -73.3 -16.55 61.37 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 175.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.7 t -70.4 -36.59 74.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.137 1.375 . . . . 0.0 109.6 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.39 2.74 31.56 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.108 1.763 . . . . 0.0 113.406 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.42 ' CE3' HD11 ' A' ' 525' ' ' ILE . 14.3 t90 -75.7 73.56 2.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.75 1.22 . . . . 0.0 108.693 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.45 -13.12 47.1 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.243 2.617 . . . . 0.0 111.182 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -52.61 -20.06 2.77 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.254 2.622 . . . . 0.0 113.205 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.785 HD13 ' CD2' ' A' ' 457' ' ' LEU . 54.0 mt -51.81 -69.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 128.813 2.845 . . . . 0.0 111.459 175.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -162.7 -94.79 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.77 1.294 . . . . 0.0 110.537 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -152.84 164.56 37.62 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.5 2.72 . . . . 0.0 108.22 -176.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -21.35 64.78 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 120.097 1.317 . . . . 0.0 113.829 174.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.22 -57.42 3.27 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.937 1.695 . . . . 0.0 108.769 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 16.3 mt -71.17 -2.07 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.504 1.522 . . . . 0.0 110.199 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.498 ' HB1' ' CD1' ' A' ' 457' ' ' LEU . . . -56.56 -64.08 0.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.666 1.121 . . . . 0.0 108.258 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 464' ' ' LEU . 30.7 tt0 -55.47 -35.81 65.91 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.827 0.451 . . . . 0.0 111.285 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -51.19 59.36 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 117.346 -1.311 . . . . 0.0 110.473 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 52.6 m -57.96 -36.7 72.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.615 1.966 . . . . 0.0 110.079 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.566 ' CD2' HD22 ' A' ' 464' ' ' LEU . 73.3 t80 -62.22 -56.01 22.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.464 -0.779 . . . . 0.0 110.75 175.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 52.3 m -62.34 -42.52 99.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.089 -0.958 . . . . 0.0 108.944 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.42 -47.26 82.22 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.87 1.268 . . . . 0.0 110.201 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . 0.561 ' HB2' HG21 ' A' ' 453' ' ' ILE . 8.7 t -66.68 -44.53 81.53 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.164 0.986 . . . . 0.0 110.919 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.402 ' CD1' HG23 ' A' ' 468' ' ' VAL . 1.0 OUTLIER -55.46 -51.09 68.07 Favored 'General case' 0 C--O 1.202 -1.421 0 C-N-CA 125.157 1.383 . . . . 0.0 108.935 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -60.14 -43.94 95.33 Favored 'General case' 0 C--N 1.372 1.564 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -66.36 -38.52 87.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 120.046 -1.659 . . . . 0.0 111.59 -178.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . 0.485 ' HE3' ' CD2' ' A' ' 454' ' ' LEU . 0.5 OUTLIER -64.97 -54.91 23.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.454 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.0 m-85 -60.43 -47.39 86.31 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.025 1.33 . . . . 0.0 108.1 -175.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -52.23 -51.93 55.4 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.227 2.211 . . . . 0.0 110.377 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.1 t -51.48 -50.57 59.6 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.482 0.713 . . . . 0.0 111.342 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 474' ' ' LEU . 55.8 mt -66.19 -40.96 90.8 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.722 1.209 . . . . 0.0 111.374 -174.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.06 -38.7 92.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.651 1.981 . . . . 0.0 109.201 174.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -49.96 54.65 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.488 1.515 . . . . 0.0 109.766 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 13.6 mt -58.23 -45.96 86.77 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.291 1.436 . . . . 0.0 109.586 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -59.96 -46.76 88.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.068 0.947 . . . . 0.0 109.648 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -53.84 -47.73 70.65 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.67 -50.07 73.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.396 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -43.63 81.41 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.423 1.889 . . . . 0.0 110.605 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.564 ' HB2' HD21 ' A' ' 571' ' ' LEU . 11.1 mt -59.25 -52.64 64.8 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.696 1.199 . . . . 0.0 109.365 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 33.4 mm -63.62 -34.94 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 121.379 1.899 . . . . 0.0 113.1 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -57.64 -37.5 73.45 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -67.96 2.24 2.18 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 128.593 2.757 . . . . 0.0 112.999 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -94.22 -54.4 3.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 119.809 1.186 . . . . 0.0 111.606 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -72.07 8.57 1.22 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.855 1.262 . . . . 0.0 113.451 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.5 p -124.44 -67.4 0.92 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.11 0.964 . . . . 0.0 110.599 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.59 -68.06 0.82 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.695 1.998 . . . . 0.0 109.181 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 140.02 132.07 2.84 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 126.409 1.957 . . . . 0.0 108.544 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.7 120.47 22.68 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.86 172.93 0.48 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.087 0.946 . . . . 0.0 109.712 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.57 -45.99 90.22 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 121.322 -0.861 . . . . 0.0 109.952 172.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.29 -46.15 67.88 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-O 116.998 -1.477 . . . . 0.0 110.319 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -62.63 -42.71 99.75 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 121.116 1.78 . . . . 0.0 110.262 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -59.48 -37.58 78.59 Favored 'General case' 0 C--N 1.343 0.306 0 O-C-N 120.897 -1.127 . . . . 0.0 110.9 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 39.4 mt -73.48 -39.92 64.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.512 176.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -46.54 56.91 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.649 1.58 . . . . 0.0 107.832 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 554' ' ' LEU . 3.1 mt -55.99 -45.89 78.86 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 174.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -47.73 77.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.661 1.119 . . . . 0.0 108.144 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -32.73 73.33 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 118.943 -0.551 . . . . 0.0 111.093 -178.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.74 -37.91 82.81 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.701 1.137 . . . . 0.0 110.347 174.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -71.58 -31.3 66.8 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 120.409 -1.432 . . . . 0.0 109.801 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -73.31 -25.41 60.64 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.608 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -78.04 -35.0 50.24 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.854 1.661 . . . . 0.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 5.0 mt . . . . . 0 N--CA 1.474 0.731 0 C-N-CA 125.801 1.64 . . . . 0.0 111.911 176.08 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 1.5 mtt . . . . . 0 N--CA 1.495 1.822 0 CA-C-O 120.972 0.415 . . . . 0.0 110.604 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . 0.544 ' HD2' HD21 ' A' ' 519' ' ' LEU . 12.6 mmt85 -59.98 -30.41 69.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.021 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 534' ' ' THR . 1.5 mm -63.7 -52.98 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 120.067 1.303 . . . . 0.0 108.162 174.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.87 -52.9 63.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.571 1.078 . . . . 0.0 108.389 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 38.7 mt -66.63 -53.5 34.71 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.082 -176.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -55.6 -41.37 81.67 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 128.19 2.805 . . . . 0.0 112.234 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.3 mt -70.92 -36.03 72.51 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 118.073 -0.965 . . . . 0.0 109.399 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -27.97 67.13 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.259 1.391 . . . . 0.0 111.744 173.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.448 ' HA ' HD23 ' A' ' 503' ' ' LEU . 33.6 t -69.24 -56.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 125.089 1.356 . . . . 0.0 107.908 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -75.9 -8.51 57.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.488 ' HB3' HD12 ' A' ' 464' ' ' LEU . 20.4 t-20 -146.96 70.65 12.21 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 121.198 -0.939 . . . . 0.0 111.706 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.52 -17.85 60.32 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.832 1.688 . . . . 0.0 111.446 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.91 -22.87 64.14 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 120.343 -1.473 . . . . 0.0 112.352 173.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.63 HD13 ' CD1' ' A' ' 535' ' ' PHE . 49.3 mt -59.84 -14.99 17.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.531 1.06 . . . . 0.0 109.907 173.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.26 -20.57 66.48 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.743 -0.598 . . . . 0.0 112.299 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 77.4 m -83.96 -26.19 29.44 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 119.387 0.994 . . . . 0.0 110.254 173.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.551 HD12 HD23 ' A' ' 464' ' ' LEU . 28.6 mt -84.98 -14.98 45.81 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.355 -0.84 . . . . 0.0 112.275 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 489' ' ' VAL . 3.0 p -69.41 152.09 96.56 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.467 ' CD ' HD11 ' A' ' 539' ' ' LEU . 18.1 Cg_endo -73.74 170.63 19.57 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.063 1.842 . . . . 0.0 111.488 173.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -74.51 2.28 6.51 Favored 'Trans proline' 0 CA--C 1.541 0.838 1 C-N-CA 125.533 4.155 . . . . 0.0 113.953 173.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.571 HD23 HH11 ' A' ' 486' ' ' ARG . 1.0 OUTLIER 71.09 65.82 0.17 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.92 2.488 . . . . 0.0 110.854 174.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -73.23 -72.98 0.23 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.51 1.124 . . . . 0.0 110.206 -173.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.88 13.72 13.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.665 1.186 . . . . 0.0 112.397 176.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.511 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.3 OUTLIER -87.14 -85.52 0.17 Allowed 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 -173.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.0 t0 62.47 152.13 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 O-C-N 126.384 2.302 . . . . 0.0 111.944 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -84.31 -18.46 36.24 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 118.678 -2.514 . . . . 0.0 108.896 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -78.3 -9.03 59.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.885 1.674 . . . . 0.0 112.95 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -116.74 5.98 13.2 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.569 1.547 . . . . 0.0 111.186 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.666 HD13 ' HG ' ' A' ' 482' ' ' LEU . 0.4 OUTLIER -129.29 163.02 49.02 Favored Pre-proline 0 C--O 1.221 -0.433 0 C-N-CA 126.226 1.81 . . . . 0.0 110.193 -179.051 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -80.89 -67.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 120.867 1.045 . . . . 0.0 112.991 -172.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -128.03 25.06 4.99 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.666 ' HG ' HD13 ' A' ' 479' ' ' LEU . 1.7 tm? -62.47 -31.22 71.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.051 -0.976 . . . . 0.0 108.565 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.09 -38.28 6.09 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-O 118.644 -1.087 . . . . 0.0 111.696 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -55.55 33.33 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.09 1.945 . . . . 0.0 111.728 174.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.53 ' HB3' HD22 ' A' ' 482' ' ' LEU . 81.9 t80 -53.69 -54.78 33.05 Favored 'General case' 0 C--N 1.337 0.029 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.721 174.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.571 HH11 HD23 ' A' ' 471' ' ' LEU . 2.2 ttp85 -55.61 -46.18 77.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.535 0.734 . . . . 0.0 110.973 -173.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.59 -39.01 70.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.837 1.255 . . . . 0.0 110.719 -175.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.784 HD11 HD21 ' A' ' 516' ' ' LEU . 2.5 mt -61.16 -46.28 91.16 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 123.282 0.633 . . . . 0.0 109.862 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 468' ' ' VAL . 67.4 t -61.92 -47.85 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-O 118.095 -0.955 . . . . 0.0 108.606 176.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -54.38 -47.23 72.91 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.616 1.566 . . . . 0.0 109.982 -177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . 0.734 HG22 HE22 ' A' ' 495' ' ' GLN . 89.5 m -63.96 -47.49 80.2 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 126.07 1.748 . . . . 0.0 109.894 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.2 m -60.74 -36.93 80.13 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.213 -2.18 . . . . 0.0 111.923 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.46 -26.82 68.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.939 2.096 . . . . 0.0 111.55 173.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.78 -53.67 7.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.579 1.552 . . . . 0.0 108.345 173.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.734 HE22 HG22 ' A' ' 491' ' ' THR . 0.4 OUTLIER -64.06 101.06 0.24 Allowed Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 119.645 1.111 . . . . 0.0 111.883 -175.044 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -63.25 128.73 23.44 Favored 'Trans proline' 0 N--CA 1.439 -1.717 0 N-CA-C 107.329 -1.835 . . . . 0.0 107.329 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.63 48.05 56.7 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 124.374 0.988 . . . . 0.0 113.093 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.601 HD21 HD13 ' A' ' 503' ' ' LEU . 32.6 tp -63.61 155.54 29.39 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.149 0.979 . . . . 0.0 110.272 173.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.0 163.65 29.8 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.568 1.947 . . . . 0.0 108.19 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 86.0 m -51.34 -46.69 62.75 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.182 0.993 . . . . 0.0 110.551 173.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.41 -43.89 14.59 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -62.0 -24.2 66.9 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.778 0.831 . . . . 0.0 111.188 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.601 HD13 HD21 ' A' ' 498' ' ' LEU . 24.1 tp -67.09 -51.22 57.04 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 123.876 0.87 . . . . 0.0 110.778 176.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.8 mt -61.18 -34.41 75.01 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 122.76 0.424 . . . . 0.0 110.151 173.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.98 -39.29 90.22 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.466 -0.771 . . . . 0.0 112.318 177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -65.6 -17.84 64.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.615 1.566 . . . . 0.0 112.577 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -117.26 21.37 13.18 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.99 2.116 . . . . 0.0 110.776 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.18 131.2 50.07 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 119.952 -1.718 . . . . 0.0 109.194 -175.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 67.86 31.08 74.93 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 173.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.796 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.9 m -102.31 148.69 25.15 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.74 -21.66 64.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.797 1.239 . . . . 0.0 111.362 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 t-20 -92.6 -15.75 26.49 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.463 1.505 . . . . 0.0 111.58 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.78 -47.57 59.62 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.77 61.59 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.232 1.013 . . . . 0.0 113.28 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 30.0 m -66.48 -48.74 68.89 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.116 0.966 . . . . 0.0 110.382 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.784 HD21 HD11 ' A' ' 488' ' ' LEU . 65.2 mt -57.06 -39.43 74.9 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.351 1.46 . . . . 0.0 111.961 174.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -75.02 -34.3 61.9 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 127.296 2.238 . . . . 0.0 110.923 -177.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -33.98 75.85 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 173.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.544 HD21 ' HD2' ' A' ' 452' ' ' ARG . 77.2 mt -78.83 -13.87 59.56 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.953 1.251 . . . . 0.0 114.353 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.5 t -72.86 -60.46 2.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.144 1.378 . . . . 0.0 108.739 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -71.1 0.76 6.92 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.646 1.578 . . . . 0.0 113.973 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.96 111.13 3.18 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 124.257 1.023 . . . . 0.0 111.903 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.53 0.25 47.14 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.59 2.356 . . . . 0.0 110.095 -175.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.25 -18.88 60.57 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 125.983 1.713 . . . . 0.0 111.759 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -122.19 -78.58 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 131.26 3.824 . . . . 0.0 109.743 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.3 59.95 4.11 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.151 1.78 . . . . 0.0 111.914 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -153.7 170.78 20.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.853 0.861 . . . . 0.0 110.914 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.22 -32.07 4.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 127.55 2.34 . . . . 0.0 110.911 173.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -84.84 -55.82 3.89 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 120.552 -1.343 . . . . 0.0 109.115 -177.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 63.7 mt -58.05 -27.64 32.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 124.235 1.014 . . . . 0.0 108.56 174.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.91 -59.93 3.62 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 125.168 1.387 . . . . 0.0 109.978 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.28 -42.95 64.16 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.386 0.994 . . . . 0.0 109.75 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -48.65 66.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . 0.546 ' CG2' HD12 ' A' ' 453' ' ' ILE . 89.3 m -61.96 -32.75 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.79 2.036 . . . . 0.0 108.298 177.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.63 ' CD1' HD13 ' A' ' 464' ' ' LEU . 53.9 t80 -64.68 -58.71 5.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 125.496 1.519 . . . . 0.0 109.839 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -60.0 -43.82 94.95 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.303 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.45 -43.41 68.05 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 120.878 1.672 . . . . 0.0 109.473 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . 0.404 ' HB2' ' CG2' ' A' ' 453' ' ' ILE . 2.6 t -71.07 -48.23 53.82 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.467 HD11 ' CD ' ' A' ' 469' ' ' PRO . 0.7 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 176.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -43.91 96.78 Favored 'General case' 0 C--N 1.355 0.833 0 CA-C-O 117.776 -1.107 . . . . 0.0 108.967 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -67.38 -38.44 84.73 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.458 -1.401 . . . . 0.0 111.285 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -54.57 38.25 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.654 ' HA ' HD12 ' A' ' 546' ' ' LEU . 8.5 m-85 -56.39 -48.23 77.31 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.49 1.916 . . . . 0.0 109.783 178.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.19 -50.48 71.09 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 127.15 2.18 . . . . 0.0 110.134 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.0 t -50.84 -41.28 57.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.002 0.921 . . . . 0.0 111.253 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.654 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.8 mt -72.85 -41.66 64.55 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 120.504 -1.372 . . . . 0.0 110.596 -176.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 547' ' ' LEU . 21.9 mt -59.56 -45.07 92.89 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 173.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -63.04 -50.78 69.29 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.008 2.123 . . . . 0.0 110.164 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.71 -44.03 77.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.192 1.797 . . . . 0.0 110.08 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -57.35 -46.89 82.86 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.777 -0.63 . . . . 0.0 109.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -55.36 -47.18 76.15 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.661 1.184 . . . . 0.0 110.457 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.44 -39.4 88.87 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -39.81 93.41 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 124.987 1.315 . . . . 0.0 111.256 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.461 ' HB2' HD21 ' A' ' 571' ' ' LEU . 3.6 mt -60.56 -55.2 36.19 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 571' ' ' LEU . 23.1 mm -60.68 -41.26 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 121.068 1.758 . . . . 0.0 111.199 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -62.74 -15.59 53.9 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 119.985 -1.697 . . . . 0.0 113.134 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -98.43 13.79 30.42 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 129.263 3.025 . . . . 0.0 111.028 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -104.25 -61.78 1.4 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 120.502 1.501 . . . . 0.0 109.736 173.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -63.91 -7.75 9.15 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 79.2 p -113.01 -64.4 1.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.065 2.546 . . . . 0.0 109.05 -173.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -93.42 -64.51 1.08 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.102 2.161 . . . . 0.0 111.023 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 134.52 119.95 2.01 Favored Glycine 0 CA--C 1.529 0.961 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 563' ' ' LEU . 7.1 mt -78.22 131.16 37.03 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.11 171.28 5.79 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.35 -43.89 96.4 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.794 -0.622 . . . . 0.0 110.594 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.49 -54.32 29.97 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 571' ' ' LEU . 13.6 mm-40 -60.18 -30.53 69.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 O-C-N 119.534 -1.978 . . . . 0.0 115.658 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -68.44 -32.97 73.37 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.641 1.176 . . . . 0.0 109.971 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.42 -38.17 50.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 117.824 -1.084 . . . . 0.0 108.72 174.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.91 -44.22 50.1 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 119.857 1.208 . . . . 0.0 108.256 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 555' ' ' ILE . 1.1 mp -57.79 -44.55 86.37 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.47 175.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -46.8 79.7 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.421 1.464 . . . . 0.0 108.542 177.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -30.33 70.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -39.86 70.87 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.494 1.518 . . . . 0.0 110.016 173.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -65.11 -38.91 92.23 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.636 1.574 . . . . 0.0 110.887 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -34.35 77.68 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.11 174.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -32.49 63.62 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 128.228 2.611 . . . . 0.0 111.497 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER . . . . . 0 C--O 1.259 1.572 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 -179.269 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 ptt? . . . . . 0 N--CA 1.476 0.826 0 N-CA-C 115.551 1.686 . . . . 0.0 115.551 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 65.6 mtt-85 -81.69 -48.06 12.17 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 116.363 -1.779 . . . . 0.0 110.881 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.52 HG23 ' CD1' ' A' ' 457' ' ' LEU . 0.5 OUTLIER -57.64 -49.77 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.081 1.309 . . . . 0.0 109.514 -177.182 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.61 -41.97 64.16 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.661 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 96.7 mt -73.52 -53.49 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 119.498 1.044 . . . . 0.0 112.195 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.95 -29.08 72.53 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 119.74 1.155 . . . . 0.0 113.737 -173.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 525' ' ' ILE . 40.5 mt -70.91 -43.12 68.95 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.571 1.186 . . . . 0.0 108.73 174.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.57 -35.19 77.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.488 1.515 . . . . 0.0 110.765 174.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.28 -47.05 95.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.29 -0.881 . . . . 0.0 110.245 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -83.09 -14.38 53.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.522 0.729 . . . . 0.0 110.822 -174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.425 ' HB3' HD12 ' A' ' 464' ' ' LEU . 55.6 t-20 -145.09 78.6 12.33 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.511 1.924 . . . . 0.0 111.403 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.72 -20.01 64.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 121.019 1.146 . . . . 0.0 113.331 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.56 -15.95 59.45 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.137 1.335 . . . . 0.0 111.109 174.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.425 HD12 ' HB3' ' A' ' 461' ' ' ASN . 45.3 mt -63.4 -15.76 58.52 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 121.022 -1.048 . . . . 0.0 109.942 173.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -63.72 -25.22 68.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.932 0.787 . . . . 0.0 110.831 173.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 63.4 m -83.54 -17.4 41.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 0.999 . . . . 0.0 111.881 174.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.4 mt -94.34 -5.59 46.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 111.98 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 489' ' ' VAL . 7.1 p -82.95 144.81 48.39 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 120.662 1.574 . . . . 0.0 108.691 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.66 164.38 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.586 2.857 . . . . 0.0 111.461 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -67.57 12.87 0.18 Allowed 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 124.232 3.288 . . . . 0.0 114.445 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.319 1.7 mp 80.67 8.34 1.27 Allowed 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 129.207 3.003 . . . . 0.0 115.664 173.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -33.33 -55.2 0.42 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.188 2.995 . . . . 0.0 115.01 -174.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.09 -5.53 21.99 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.757 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.446 HD21 ' CE1' ' A' ' 543' ' ' PHE . 45.6 mt -71.21 -86.29 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.561 1.544 . . . . 0.0 110.887 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . 0.276 24.2 t0 58.96 140.97 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.946 3.298 . . . . 0.0 111.696 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -65.64 -29.91 70.55 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.234 1.814 . . . . 0.0 110.285 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -63.59 -24.2 67.7 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.764 1.165 . . . . 0.0 112.431 174.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -92.43 -17.23 24.86 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 120.934 1.697 . . . . 0.0 112.077 176.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.47 ' HG ' HD21 ' A' ' 546' ' ' LEU . 7.1 mt -128.32 86.32 58.18 Favored Pre-proline 0 CA--C 1.515 -0.378 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.76 90.15 0.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.057 1.838 . . . . 0.0 110.058 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 134.17 -16.18 4.44 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.537 2.018 . . . . 0.0 113.156 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 479' ' ' LEU . 4.6 tp -58.19 -24.43 59.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.326 2.063 . . . . 0.0 110.277 173.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.6 -41.49 12.84 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 118.689 0.677 . . . . 0.0 111.875 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -40.79 94.09 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.148 1.474 . . . . 0.0 111.363 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -65.07 -53.03 52.01 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.89 1.276 . . . . 0.0 109.776 173.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -41.56 99.49 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.524 0.73 . . . . 0.0 111.127 -173.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.79 -44.0 82.43 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.815 0.846 . . . . 0.0 109.542 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.602 HD11 HD21 ' A' ' 516' ' ' LEU . 3.4 mt -54.8 -51.46 65.73 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.966 0.506 . . . . 0.0 111.023 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 468' ' ' VAL . 55.4 t -56.81 -47.65 82.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 125.097 1.359 . . . . 0.0 109.924 175.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -55.46 -45.08 76.92 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.473 1.509 . . . . 0.0 110.079 179.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.3 m -65.41 -40.19 93.07 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.791 1.636 . . . . 0.0 111.263 174.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.8 m -64.85 -44.27 90.3 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 120.022 1.283 . . . . 0.0 110.397 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.24 -20.67 59.88 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.097 1.359 . . . . 0.0 112.815 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 16.8 t -93.43 -37.42 11.97 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.381 1.872 . . . . 0.0 111.367 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -76.76 105.79 2.75 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.95 1.3 . . . . 0.0 110.065 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.64 115.05 4.2 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.792 1.661 . . . . 0.0 110.94 -173.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.54 36.92 47.75 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.38 155.47 11.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.006 0.922 . . . . 0.0 110.542 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 10.8 p -139.87 174.09 10.87 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.2 m -55.95 -50.04 71.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.644 0.777 . . . . 0.0 109.859 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.08 -43.57 47.95 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -174.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -66.34 -24.52 66.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.347 1.059 . . . . 0.0 110.585 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.47 -52.47 61.24 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 119.609 1.095 . . . . 0.0 109.035 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.83 -38.77 89.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 118.551 -0.738 . . . . 0.0 109.919 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.66 -40.98 98.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.404 0.682 . . . . 0.0 110.709 177.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.59 -20.49 63.64 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.152 -0.968 . . . . 0.0 112.713 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -106.61 14.36 27.09 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.392 1.077 . . . . 0.0 109.004 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -58.59 119.93 7.94 Favored 'General case' 0 CA--C 1.528 0.118 0 O-C-N 119.801 -1.812 . . . . 0.0 111.41 -174.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.9 15.98 66.35 Favored Glycine 0 CA--C 1.527 0.783 0 CA-C-O 119.176 -0.791 . . . . 0.0 113.012 177.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.842 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.3 m -98.17 153.07 18.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -173.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -60.19 -20.35 58.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.225 -0.922 . . . . 0.0 112.039 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.842 ' H ' HG22 ' A' ' 510' ' ' THR . 76.5 m-20 -89.83 -19.31 24.81 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.128 1.771 . . . . 0.0 110.519 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.61 -51.13 58.09 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 124.473 1.109 . . . . 0.0 110.213 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.92 -44.18 60.08 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.942 0.897 . . . . 0.0 112.321 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 53.0 m -62.24 -50.41 71.84 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.884 174.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.602 HD21 HD11 ' A' ' 488' ' ' LEU . 21.9 mt -60.09 -39.15 85.12 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.555 1.07 . . . . 0.0 111.534 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.94 -45.79 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.807 2.043 . . . . 0.0 109.381 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -61.42 -29.86 70.2 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.335 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 73.8 mt -88.41 -6.37 57.71 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.782 1.233 . . . . 0.0 112.168 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.9 t -83.24 -50.29 8.56 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 126.46 1.904 . . . . 0.0 109.081 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.92 9.37 6.56 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.879 1.271 . . . . 0.0 113.1 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -76.58 78.23 3.26 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.942 1.697 . . . . 0.0 113.448 -172.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.55 -0.78 0.07 Allowed 'General case' 0 CA--C 1.534 0.33 1 C-N-CA 131.797 4.039 . . . . 0.0 113.526 174.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.7 -26.92 36.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.044 2.138 . . . . 0.0 111.49 174.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -112.73 -50.69 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 125.84 1.656 . . . . 0.0 110.72 175.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 42.97 47.19 4.9 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.571 1.948 . . . . 0.0 113.306 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.0 173.01 16.57 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 174.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -131.28 -19.96 2.74 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 127.19 2.196 . . . . 0.0 111.809 177.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.88 -56.13 3.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.211 2.204 . . . . 0.0 106.902 173.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 65.2 mt -59.06 -28.33 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.087 0.555 . . . . 0.0 109.75 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.11 -40.15 67.04 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.564 1.145 . . . . 0.0 111.937 176.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -49.97 65.78 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.362 0.983 . . . . 0.0 109.588 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -62.31 -46.57 88.13 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.768 0.427 . . . . 0.0 110.448 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.7 m -66.29 -30.64 71.11 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.604 1.161 . . . . 0.0 110.253 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -69.7 -46.14 66.66 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 119.632 1.106 . . . . 0.0 108.985 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 56.7 m -61.25 -41.08 96.28 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.273 0.488 . . . . 0.0 110.315 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.6 -47.46 86.1 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.997 0.919 . . . . 0.0 111.074 174.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 20.5 t -63.7 -44.9 92.28 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.156 -0.965 . . . . 0.0 111.963 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.02 -50.92 69.56 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.44 -0.79 . . . . 0.0 109.74 175.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -54.77 -44.52 73.77 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.12 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -66.7 -35.57 80.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 119.868 1.213 . . . . 0.0 111.044 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -49.12 71.28 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 174.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.446 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.3 m-85 -64.18 -47.09 81.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.687 0.676 . . . . 0.0 111.303 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.75 -49.05 69.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.419 2.687 . . . . 0.0 108.53 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 23.2 t -58.68 -42.66 89.02 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.708 -0.62 . . . . 0.0 111.48 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.47 HD21 ' HG ' ' A' ' 479' ' ' LEU . 60.2 mt -71.61 -32.33 67.89 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 119.165 0.893 . . . . 0.0 110.155 -175.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.7 mt -70.85 -41.05 71.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.618 0.767 . . . . 0.0 109.118 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.29 -50.58 71.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.002 0.921 . . . . 0.0 109.184 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 51.7 mt -57.83 -39.06 76.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.206 1.003 . . . . 0.0 110.448 174.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -61.84 -42.94 99.66 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 118.103 -0.951 . . . . 0.0 108.771 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.61 -41.34 97.33 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 116.108 -1.901 . . . . 0.0 110.368 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.37 -46.0 90.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.177 2.262 . . . . 0.0 109.811 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -63.17 -39.09 93.64 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -174.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.58 -51.46 42.33 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.956 1.302 . . . . 0.0 111.388 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.8 mm -64.16 -36.62 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 119.536 1.062 . . . . 0.0 109.123 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.45 -33.61 75.94 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.335 -1.478 . . . . 0.0 111.48 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 52.0 mtt-85 -61.14 -32.43 72.13 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 116.331 -1.795 . . . . 0.0 109.323 173.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -57.22 -42.29 81.08 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 121.402 1.91 . . . . 0.0 110.527 176.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.94 3.65 7.9 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -177.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.497 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.92 -85.89 0.09 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.417 1.008 . . . . 0.0 108.934 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.497 ' H ' HG23 ' A' ' 560' ' ' THR . 3.2 m-70 -47.4 -41.32 19.71 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.994 2.118 . . . . 0.0 113.558 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.8 101.16 1.21 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.15 132.61 54.54 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 173.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 170.58 13.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 122.918 1.342 . . . . 0.0 109.249 176.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -40.02 94.86 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.804 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -46.63 60.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.706 1.879 . . . . 0.0 109.124 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -65.39 -35.27 80.44 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.517 1.053 . . . . 0.0 111.598 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.4 ' HA ' HD12 ' A' ' 571' ' ' LEU . 9.7 ttm180 -63.01 -31.75 72.96 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 120.595 -1.315 . . . . 0.0 109.472 174.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 5.0 mp -78.23 -32.3 49.71 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.458 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.49 -43.38 84.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.699 1.59 . . . . 0.0 107.671 173.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 568' ' ' ARG . 3.4 mt -58.22 -39.84 80.08 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-O 116.481 -1.723 . . . . 0.0 113.269 175.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -62.38 -40.68 97.26 Favored 'General case' 0 C--N 1.345 0.413 0 CA-C-N 122.383 2.356 . . . . 0.0 109.095 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -41.63 76.55 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -40.21 87.6 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.595 -1.315 . . . . 0.0 110.77 174.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -57.93 -42.98 86.0 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.758 1.223 . . . . 0.0 110.331 174.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.43 -27.8 52.36 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.295 1.407 . . . . 0.0 111.375 -176.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.47 -42.29 83.22 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 22.8 mt . . . . . 0 C--O 1.218 -0.593 0 CA-C-N 118.7 0.682 . . . . 0.0 110.887 -178.909 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 17.5 ptt? . . . . . 0 CA--C 1.539 0.557 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.7 mmm-85 -59.75 -39.68 85.58 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-O 118.179 -0.915 . . . . 0.0 109.61 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 mm -67.98 -43.83 85.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.147 0 CA-C-O 115.146 -2.359 . . . . 0.0 108.873 176.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.631 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 2.9 mm? -59.05 -54.51 46.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.47 1.941 . . . . 0.0 108.694 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.436 HG23 HD13 ' A' ' 488' ' ' LEU . 25.6 mt -59.97 -59.63 3.74 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 124.266 1.026 . . . . 0.0 111.098 177.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.36 -29.32 71.17 Favored Glycine 0 N--CA 1.468 0.787 0 CA-C-N 120.847 1.658 . . . . 0.0 113.551 -173.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.589 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.1 OUTLIER -71.34 -45.89 61.87 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.44 -32.12 73.47 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 127.415 2.286 . . . . 0.0 110.83 175.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 503' ' ' LEU . 18.6 t -66.67 -55.08 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 124.654 1.182 . . . . 0.0 108.201 174.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 500' ' ' THR . 76.5 mt-30 -72.2 -17.73 61.91 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 118.707 -0.663 . . . . 0.0 112.461 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.448 ' HB3' HD12 ' A' ' 464' ' ' LEU . 53.0 t-20 -146.29 80.62 10.01 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 127.164 2.186 . . . . 0.0 110.68 -174.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.6 -20.92 34.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.207 1.938 . . . . 0.0 112.296 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -66.92 -18.92 65.61 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.929 0.892 . . . . 0.0 110.039 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 461' ' ' ASN . 43.9 mt -63.85 -12.09 33.27 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.953 1.706 . . . . 0.0 110.179 173.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.94 87.93 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 119.015 0.825 . . . . 0.0 109.818 173.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 61.3 m -69.21 -13.28 62.32 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.899 0.772 . . . . 0.0 111.967 174.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.71 -15.91 20.16 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.403 1.002 . . . . 0.0 112.573 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -80.26 146.49 62.47 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -74.33 169.06 23.35 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.829 3.019 . . . . 0.0 112.072 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.83 0.51 5.59 Favored 'Trans proline' 0 CA--C 1.552 1.381 0 C-N-CA 122.703 2.269 . . . . 0.0 114.819 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.879 HD22 HD11 ' A' ' 482' ' ' LEU 0.286 1.2 mp 76.04 39.92 0.28 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 130.063 3.345 . . . . 0.0 115.816 177.225 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.68 -51.55 48.33 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.299 1.44 . . . . 0.0 114.108 -178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.72 2.49 19.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.004 -1.685 . . . . 0.0 111.732 174.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.53 HD21 ' CE1' ' A' ' 543' ' ' PHE . 5.8 mp -112.4 -74.29 0.64 Allowed 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 123.375 0.67 . . . . 0.0 111.083 -173.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 5.9 t70 60.06 169.24 0.08 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.928 1.823 . . . . 0.0 110.348 -173.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -84.23 -24.4 30.05 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 125.823 1.649 . . . . 0.0 108.886 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -56.12 -48.43 76.22 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 126.397 1.879 . . . . 0.0 108.609 173.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -74.81 -32.04 61.87 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 119.012 -1.075 . . . . 0.0 111.99 -174.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.42 ' CD1' HD21 ' A' ' 546' ' ' LEU . 17.0 mt -131.09 115.92 16.61 Favored Pre-proline 0 C--O 1.225 -0.214 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -173.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.25 -51.47 0.34 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 CA-C-N 120.67 1.275 . . . . 0.0 111.739 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -67.08 -19.9 70.44 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.862 1.22 . . . . 0.0 112.207 -177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.879 HD11 HD22 ' A' ' 471' ' ' LEU . 1.4 tm? -61.15 -33.5 73.51 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.567 1.547 . . . . 0.0 110.418 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.35 -47.86 6.9 Favored Glycine 0 CA--C 1.527 0.814 0 O-C-N 123.833 0.708 . . . . 0.0 111.844 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.731 HD11 HD21 ' A' ' 512' ' ' ASN . 0.9 OUTLIER -59.8 -41.35 91.03 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.133 0.973 . . . . 0.0 112.315 176.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.631 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 41.2 t80 -66.81 -51.17 58.88 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.578 1.535 . . . . 0.0 109.777 174.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -55.63 -47.31 76.82 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 118.449 0.568 . . . . 0.0 111.0 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.48 -39.99 92.59 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.891 0.876 . . . . 0.0 110.792 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.477 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -64.06 -47.6 79.53 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.85 1.26 . . . . 0.0 112.484 174.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 468' ' ' VAL . 49.4 t -59.0 -49.45 83.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.465 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -55.33 -44.11 75.59 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.662 1.185 . . . . 0.0 108.944 -176.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 55.0 m -63.01 -43.86 97.59 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.671 2.389 . . . . 0.0 111.837 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.6 m -63.6 -44.06 95.11 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.251 0.932 . . . . 0.0 109.457 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -16.99 64.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.71 1.204 . . . . 0.0 111.229 173.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.68 -16.44 26.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.753 1.221 . . . . 0.0 112.293 176.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -122.26 82.45 45.48 Favored Pre-proline 0 CA--C 1.536 0.427 0 C-N-CA 124.848 1.259 . . . . 0.0 107.796 175.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -63.57 139.38 69.72 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 N-CA-C 108.114 -1.533 . . . . 0.0 108.114 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 78.69 15.45 80.76 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 118.394 -1.225 . . . . 0.0 113.996 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.05 166.4 4.73 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 120.079 1.939 . . . . 0.0 109.183 173.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.7 p -140.93 163.01 34.12 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 119.569 -1.957 . . . . 0.0 108.982 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.493 HG23 ' HA ' ' A' ' 460' ' ' GLN . 7.4 m -47.63 -41.72 22.68 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.333 1.453 . . . . 0.0 112.469 174.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -85.02 -50.38 4.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -58.0 -24.19 57.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.007 1.723 . . . . 0.0 112.119 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 459' ' ' VAL . 59.1 tp -58.6 -48.29 81.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.657 1.117 . . . . 0.0 108.865 173.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.46 -29.39 68.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.847 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.93 -43.78 78.37 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.615 0.766 . . . . 0.0 109.991 174.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.26 -21.13 61.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.77 1.168 . . . . 0.0 112.868 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -111.53 11.84 21.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.908 0.883 . . . . 0.0 110.163 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.76 126.59 24.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 120.477 -1.39 . . . . 0.0 110.832 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.97 15.39 81.22 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 118.704 -1.053 . . . . 0.0 114.501 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.753 HG22 ' H ' ' A' ' 512' ' ' ASN . 75.2 m -93.1 148.23 22.18 Favored 'General case' 0 C--O 1.246 0.893 0 CA-C-N 119.222 1.511 . . . . 0.0 108.083 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -58.29 -25.34 61.7 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.172 -0.955 . . . . 0.0 111.134 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.753 ' H ' HG22 ' A' ' 510' ' ' THR . 0.6 OUTLIER -89.61 -17.94 27.5 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.278 2.231 . . . . 0.0 112.183 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.87 -49.42 62.95 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.917 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.36 -43.79 54.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.338 0.972 . . . . 0.0 112.567 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 78.9 m -60.58 -51.33 69.88 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.477 HD21 HD11 ' A' ' 488' ' ' LEU . 76.4 mt -57.13 -44.57 83.45 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 125.541 1.536 . . . . 0.0 112.512 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.53 -39.62 88.7 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.641 1.976 . . . . 0.0 109.137 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -37.46 84.71 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 78.7 mt -82.72 -9.53 59.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.641 0.776 . . . . 0.0 112.315 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.8 t -76.24 -59.88 2.57 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 0.0 107.583 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.35 22.58 0.67 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.784 2.034 . . . . 0.0 112.777 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.5 t90 -73.03 114.71 11.49 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -173.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.17 7.95 43.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 128.413 2.685 . . . . 0.0 114.595 -173.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -70.89 -40.0 72.48 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.441 -1.412 . . . . 0.0 109.13 173.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.589 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.3 pt -108.38 -70.67 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 127.361 2.264 . . . . 0.0 110.73 -174.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.12 37.79 11.57 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.76 2.024 . . . . 0.0 114.798 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -129.36 -178.74 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.5 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -137.07 -24.68 1.1 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.151 2.18 . . . . 0.0 112.301 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -91.18 -54.79 3.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.007 2.123 . . . . 0.0 108.073 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -62.35 -22.02 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.54 -52.75 63.59 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.279 1.4 . . . . 0.0 111.46 174.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -62.34 -42.21 99.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.301 1.41 . . . . 0.0 110.68 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -53.32 51.91 Favored 'General case' 0 C--N 1.34 0.184 0 O-C-N 122.025 -0.422 . . . . 0.0 111.079 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 33.5 m -61.26 -33.77 74.08 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.236 -1.364 . . . . 0.0 110.664 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.48 ' HB2' HD12 ' A' ' 457' ' ' LEU . 41.4 t80 -64.23 -49.32 72.42 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 121.242 1.837 . . . . 0.0 109.786 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.3 m -62.41 -45.31 93.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.411 1.084 . . . . 0.0 111.159 178.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.87 -43.79 98.13 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.12 1.368 . . . . 0.0 110.694 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 6.0 t -67.56 -45.9 74.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 124.319 1.048 . . . . 0.0 112.616 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.0 tt -54.92 -51.74 65.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -55.52 -44.53 76.75 Favored 'General case' 0 C--O 1.205 -1.245 0 C-N-CA 124.754 1.221 . . . . 0.0 111.327 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -63.3 -38.88 92.9 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.051 0.841 . . . . 0.0 112.053 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.3 -51.42 68.96 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.537 ' HA ' HD12 ' A' ' 546' ' ' LEU . 2.5 m-85 -58.1 -48.35 80.45 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.849 0.86 . . . . 0.0 111.406 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -57.52 -41.44 80.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.721 2.009 . . . . 0.0 109.495 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.5 t -56.73 -36.58 69.89 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.711 -1.243 . . . . 0.0 112.455 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 543' ' ' PHE . 14.1 mt -81.99 -35.59 28.78 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 124.747 1.219 . . . . 0.0 109.284 -176.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -40.81 91.61 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.218 1.407 . . . . 0.0 108.766 174.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -59.68 -55.68 31.31 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.718 1.607 . . . . 0.0 108.429 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 18.5 mt -52.61 -47.58 66.87 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.491 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -64.36 -44.07 92.57 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.86 1.209 . . . . 0.0 110.128 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.33 -49.29 67.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.154 0.982 . . . . 0.0 108.88 173.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.27 -40.68 86.18 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.176 0.444 . . . . 0.0 110.336 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -54.78 -48.28 72.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.917 1.287 . . . . 0.0 108.969 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.412 ' HB2' HD21 ' A' ' 571' ' ' LEU . 5.1 mt -61.86 -52.73 62.92 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.685 1.594 . . . . 0.0 110.066 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.8 mm -63.69 -35.95 74.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 121.88 2.127 . . . . 0.0 111.239 177.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.88 73.19 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 120.964 -1.085 . . . . 0.0 109.81 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 15.5 mtm180 -92.39 -3.64 54.99 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 116.724 -1.608 . . . . 0.0 111.223 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.47 -60.87 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 122.718 2.508 . . . . 0.0 105.151 173.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -14.52 62.84 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -173.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 62.2 p -114.01 -61.42 1.75 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 120.81 1.641 . . . . 0.0 109.631 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -82.25 -35.79 27.8 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.068 1.347 . . . . 0.0 113.733 -175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 77.42 80.47 0.66 Allowed Glycine 0 C--N 1.338 0.688 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 -173.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 167.1 1.54 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 173.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 8.4 t -70.19 157.89 36.81 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 120.29 -1.506 . . . . 0.0 108.949 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -38.36 75.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.27 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -63.31 -51.86 64.28 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.322 1.049 . . . . 0.0 111.094 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -53.75 -40.88 66.55 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.534 1.061 . . . . 0.0 111.361 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' A' ' 571' ' ' LEU . 4.5 tmt_? -60.93 -39.37 89.19 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.392 -1.443 . . . . 0.0 109.981 176.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 7.7 mp -72.79 -33.96 66.61 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 116.937 -1.506 . . . . 0.0 110.962 175.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.63 -43.74 62.7 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.446 1.475 . . . . 0.0 108.967 174.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' A' ' 568' ' ' ARG . 1.6 mt -57.06 -39.22 74.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -41.24 92.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 121.442 1.928 . . . . 0.0 108.157 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -35.48 80.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 122.442 0.297 . . . . 0.0 111.369 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.05 -41.35 70.9 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.578 -1.326 . . . . 0.0 109.99 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -60.24 -37.64 81.01 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.992 -1.067 . . . . 0.0 111.246 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -71.54 -32.81 68.56 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.594 1.088 . . . . 0.0 111.019 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -66.74 -40.69 88.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.08 0.952 . . . . 0.0 110.318 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 mt . . . . . 0 CA--C 1.549 0.928 0 O-C-N 121.147 -0.97 . . . . 0.0 108.791 -176.902 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.452 -0.356 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -120.53 -42.92 2.52 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.888 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 4.8 mm -68.94 -52.22 36.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.642 0 CA-C-O 117.6 -1.19 . . . . 0.0 108.788 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.1 mt -54.23 -50.17 67.76 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 120.405 1.457 . . . . 0.0 110.595 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.468 HG22 ' HG ' ' A' ' 519' ' ' LEU . 81.9 mt -64.58 -55.6 20.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.163 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.98 -44.1 92.88 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 120.045 1.293 . . . . 0.0 112.815 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.675 HD21 HG21 ' A' ' 525' ' ' ILE . 50.9 mt -65.26 -50.28 66.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.459 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.82 -34.42 74.51 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.963 0.801 . . . . 0.0 111.744 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.64 -48.85 84.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 120.899 -1.125 . . . . 0.0 109.679 175.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -79.12 -17.11 55.67 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.918 -0.489 . . . . 0.0 111.685 175.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.563 ' HB3' HD12 ' A' ' 464' ' ' LEU . 24.9 t-20 -131.42 70.96 81.78 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-N 119.637 1.108 . . . . 0.0 109.198 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.85 -18.89 53.06 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.704 1.603 . . . . 0.0 111.576 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -67.45 -23.0 65.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.925 0.89 . . . . 0.0 110.605 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 461' ' ' ASN . 63.2 mt -62.12 -12.51 19.89 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 120.867 -1.145 . . . . 0.0 110.356 173.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -59.7 -39.79 85.74 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.946 1.248 . . . . 0.0 111.673 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 53.6 m -77.17 -13.96 59.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 120.163 1.347 . . . . 0.0 111.993 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.3 mt -90.73 -19.27 23.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.356 1.063 . . . . 0.0 112.516 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -81.77 149.21 63.34 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.851 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 468' ' ' VAL . 17.0 Cg_endo -69.36 173.99 9.81 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.142 3.228 . . . . 0.0 112.08 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -75.06 5.21 4.15 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 124.046 3.164 . . . . 0.0 114.048 175.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.904 HD23 HD21 ' A' ' 482' ' ' LEU . 7.1 mp 67.62 53.61 0.7 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.954 2.502 . . . . 0.0 111.675 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.51 -65.66 0.9 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.95 1.3 . . . . 0.0 108.95 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.3 -12.17 60.62 Favored 'General case' 0 C--N 1.344 0.369 0 O-C-N 120.969 -1.082 . . . . 0.0 111.775 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.665 HD12 ' HG ' ' A' ' 471' ' ' LEU . 22.4 mt -82.49 -77.14 0.24 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.2 t0 65.83 150.87 0.05 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.064 1.746 . . . . 0.0 111.999 -174.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.2 -10.01 59.14 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 120.325 -1.484 . . . . 0.0 111.313 178.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -82.09 -37.39 26.41 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.141 0.976 . . . . 0.0 111.102 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -85.23 -29.51 24.6 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 118.508 -0.758 . . . . 0.0 110.414 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.623 HD21 HD11 ' A' ' 546' ' ' LEU . 3.6 mm? -116.16 89.44 25.6 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.475 1.11 . . . . 0.0 109.138 -174.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.9 87.04 0.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.293 3.328 . . . . 0.0 110.146 -176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 135.09 -15.57 4.25 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.767 1.651 . . . . 0.0 112.86 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.904 HD21 HD23 ' A' ' 471' ' ' LEU . 0.9 OUTLIER -64.05 -25.95 68.34 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-O 116.968 -1.492 . . . . 0.0 110.962 173.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.99 -40.47 12.72 Favored Glycine 0 C--O 1.218 -0.866 0 CA-C-N 119.68 1.127 . . . . 0.0 111.39 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 35.2 tp -61.33 -43.02 99.58 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.82 1.31 . . . . 0.0 112.504 176.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -66.34 -47.59 73.0 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.35 1.06 . . . . 0.0 110.527 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.537 ' HG3' HD22 ' A' ' 471' ' ' LEU . 65.6 ttt-85 -58.73 -51.13 71.28 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.197 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -43.31 99.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 123.83 0.707 . . . . 0.0 110.297 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.434 HD13 HG23 ' A' ' 455' ' ' ILE . 0.9 OUTLIER -57.82 -49.01 78.08 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 123.56 0.744 . . . . 0.0 111.609 179.143 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.67 HG11 ' CG1' ' A' ' 468' ' ' VAL . 71.9 t -62.35 -48.19 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.238 175.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -53.65 -45.76 70.33 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.907 1.683 . . . . 0.0 108.558 -176.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 3.0 m -66.47 -45.73 78.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.401 1.88 . . . . 0.0 110.359 173.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 87.5 m -57.88 -40.3 79.93 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 121.352 1.887 . . . . 0.0 112.065 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.7 -24.5 67.59 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.36 1.464 . . . . 0.0 111.774 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -49.72 12.85 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.363 0.665 . . . . 0.0 110.172 174.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -73.84 102.45 0.62 Allowed Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 124.291 1.036 . . . . 0.0 110.584 -173.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.41 124.35 11.95 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 109.626 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.73 41.98 99.76 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 123.853 0.74 . . . . 0.0 111.379 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 24.9 tp -61.13 156.17 18.84 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.528 0.68 . . . . 0.0 110.083 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.57 165.42 21.75 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.0 m -54.52 -43.25 71.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.448 1.499 . . . . 0.0 110.943 176.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -78.3 -39.14 23.63 Favored Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.42 -26.81 68.14 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.084 0.553 . . . . 0.0 111.849 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 38.2 tp -60.12 -52.68 64.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.615 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.0 mm? -65.11 -31.44 72.64 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 122.053 -0.404 . . . . 0.0 111.745 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -44.12 79.14 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.321 1.048 . . . . 0.0 110.442 175.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -61.16 -17.31 52.3 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.833 -1.167 . . . . 0.0 112.714 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -113.73 16.29 18.57 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.785 2.034 . . . . 0.0 110.141 177.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -58.44 133.21 55.57 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 119.837 -1.789 . . . . 0.0 109.149 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 69.93 27.97 72.43 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.038 -0.413 . . . . 0.0 112.581 173.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.774 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.6 m -108.14 145.91 33.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -61.72 -12.04 14.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.794 1.237 . . . . 0.0 112.062 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.774 ' H ' HG22 ' A' ' 510' ' ' THR . 4.8 m120 -107.55 -14.13 14.91 Favored 'General case' 0 C--N 1.372 1.555 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 -174.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -48.82 -51.33 30.02 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 120.394 1.452 . . . . 0.0 110.021 172.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.42 -43.26 54.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.374 1.47 . . . . 0.0 113.534 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 17.5 m -64.86 -54.07 36.83 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.417 HD21 HD11 ' A' ' 488' ' ' LEU . 9.6 mt -56.1 -34.2 65.8 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 124.278 1.031 . . . . 0.0 111.684 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.37 -39.95 92.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 126.417 1.887 . . . . 0.0 107.853 176.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -63.44 -29.74 70.97 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.126 1.33 . . . . 0.0 112.114 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.468 ' HG ' HG22 ' A' ' 455' ' ' ILE . 3.5 mm? -86.84 -41.82 13.74 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 125.954 1.702 . . . . 0.0 110.874 177.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . 0.615 ' HB2' HD21 ' A' ' 504' ' ' LEU . 14.5 t -61.29 -49.84 75.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.508 1.123 . . . . 0.0 110.323 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -71.9 -7.59 49.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 126.198 1.799 . . . . 0.0 112.729 175.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -72.89 131.21 41.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.46 14.86 7.13 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.062 1.745 . . . . 0.0 109.506 -173.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -61.23 -24.99 66.76 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.042 1.737 . . . . 0.0 110.464 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.675 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -99.1 -59.45 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 128.564 2.746 . . . . 0.0 109.403 175.279 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.37 30.54 1.58 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.253 2.221 . . . . 0.0 112.656 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -140.41 165.52 27.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.672 1.189 . . . . 0.0 108.847 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -126.52 -30.42 2.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.628 2.371 . . . . 0.0 111.142 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -79.83 -57.03 3.85 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.737 1.615 . . . . 0.0 107.74 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 51.3 mt -59.72 -28.87 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.523 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.79 -58.85 6.55 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.869 -1.062 . . . . 0.0 109.426 173.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.54 -42.72 75.0 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 120.387 1.449 . . . . 0.0 110.777 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -63.6 -55.19 25.66 Favored 'General case' 0 C--O 1.22 -0.456 0 O-C-N 121.85 -0.532 . . . . 0.0 110.303 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 98.3 m -64.02 -26.9 68.77 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.258 1.423 . . . . 0.0 110.239 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.427 ' CG ' HD13 ' A' ' 464' ' ' LEU . 86.4 t80 -64.42 -59.08 4.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.582 1.083 . . . . 0.0 109.151 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 55.8 m -60.56 -44.92 95.63 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.771 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.05 -44.71 94.48 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.667 1.121 . . . . 0.0 110.777 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 25.7 t -66.16 -49.81 66.11 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.799 2.04 . . . . 0.0 110.556 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.31 -53.6 42.19 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 123.839 0.856 . . . . 0.0 110.76 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.323 1.2 m-20 -64.25 -30.92 71.95 Favored 'General case' 0 N--CA 1.418 -2.045 0 C-N-CA 118.236 -1.385 . . . . 0.0 110.436 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -70.64 -31.56 68.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.148 1.34 . . . . 0.0 110.717 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -55.69 9.53 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.556 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.8 m-85 -56.39 -48.17 77.43 Favored 'General case' 0 C--N 1.347 0.463 0 C-N-CA 123.727 0.811 . . . . 0.0 109.568 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.5 -46.22 90.92 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.269 2.228 . . . . 0.0 110.655 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 34.9 t -51.56 -45.54 63.1 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.03 -0.419 . . . . 0.0 110.132 174.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.623 HD11 HD21 ' A' ' 479' ' ' LEU . 12.0 mt -74.0 -38.95 63.94 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.173 -176.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -47.0 87.11 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.78 -50.54 71.94 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.328 1.451 . . . . 0.0 110.974 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.61 -46.88 87.94 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.296 1.038 . . . . 0.0 109.834 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . 0.408 ' O ' HD12 ' A' ' 554' ' ' LEU . 1.5 ttm-85 -64.48 -45.84 85.63 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.518 1.127 . . . . 0.0 109.25 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.05 -53.31 52.13 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.538 1.135 . . . . 0.0 109.333 175.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -58.61 -43.91 89.78 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 117.445 -1.264 . . . . 0.0 110.097 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -50.14 74.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.723 1.209 . . . . 0.0 110.037 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.743 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.6 mt -58.37 -53.33 59.53 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.073 1.349 . . . . 0.0 108.527 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.7 mm -65.02 -39.65 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.344 1.058 . . . . 0.0 110.891 -178.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.01 -33.11 72.75 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.146 2.178 . . . . 0.0 108.258 176.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.36 -2.27 58.5 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 116.143 -1.884 . . . . 0.0 110.8 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -89.41 -44.81 9.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 122.757 2.526 . . . . 0.0 109.622 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -68.63 -3.34 11.54 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 120.603 -1.311 . . . . 0.0 114.099 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.6 OUTLIER -138.65 -87.98 0.23 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 119.469 1.031 . . . . 0.0 109.071 -175.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.645 ' H ' HG23 ' A' ' 560' ' ' THR . 8.6 m-70 -55.77 -27.58 51.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.536 1.934 . . . . 0.0 113.385 -178.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 61.37 83.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 126.499 1.999 . . . . 0.0 109.575 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.53 160.63 0.16 Allowed 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.073 0.949 . . . . 0.0 109.942 173.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.68 163.14 11.95 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.252 -1.379 . . . . 0.0 111.028 -176.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -55.04 -42.23 72.38 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.171 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.95 -50.33 69.06 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 124.806 1.242 . . . . 0.0 110.922 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -56.89 -38.62 73.04 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.174 1.352 . . . . 0.0 111.842 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.592 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -67.73 -38.84 84.08 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.83 -1.169 . . . . 0.0 109.748 176.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.06 -37.25 85.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.999 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.43 -43.08 75.01 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 124.708 1.203 . . . . 0.0 107.765 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 554' ' ' LEU . 3.5 mt -58.39 -41.12 84.16 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.575 1.15 . . . . 0.0 113.692 174.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -46.87 88.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -58.85 -44.51 91.03 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 124.675 1.235 . . . . 0.0 108.462 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -46.73 86.55 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.493 1.517 . . . . 0.0 113.131 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -62.1 -42.44 99.22 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.702 1.601 . . . . 0.0 110.204 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -72.43 -24.17 61.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 117.276 -1.345 . . . . 0.0 112.065 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.21 -37.07 61.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.711 1.205 . . . . 0.0 108.874 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 10.8 mt . . . . . 0 N--CA 1.477 0.881 0 O-C-N 120.186 -1.571 . . . . 0.0 113.093 176.715 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.0 mtt . . . . . 0 CA--C 1.537 0.467 0 N-CA-C 110.443 -0.206 . . . . 0.0 110.443 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -128.74 -42.08 1.45 Allowed 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 126.988 2.115 . . . . 0.0 108.765 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.4 mm -56.85 -52.41 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.278 0 CA-C-N 119.607 1.094 . . . . 0.0 109.039 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 34.8 mt -53.6 -33.12 53.82 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 82.0 mt -79.43 -54.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 C-N-CA 124.069 0.948 . . . . 0.0 110.208 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.17 -36.97 93.19 Favored Glycine 0 CA--C 1.523 0.546 0 CA-C-N 119.635 1.107 . . . . 0.0 111.692 -174.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -48.42 71.7 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.661 174.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.48 -31.25 69.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.459 1.103 . . . . 0.0 111.451 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.3 t -64.78 -57.78 9.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.314 1.046 . . . . 0.0 108.852 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.35 -32.4 73.99 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.226 -178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -131.48 87.4 46.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 126.069 1.747 . . . . 0.0 109.652 -174.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.33 -17.99 39.24 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.504 1.469 . . . . 0.0 113.23 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -61.28 -22.51 64.92 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.064 1.302 . . . . 0.0 110.731 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.509 HD22 ' CD2' ' A' ' 535' ' ' PHE . 76.9 mt -57.05 -19.14 17.31 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.106 0.962 . . . . 0.0 112.205 174.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.1 -26.04 68.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.737 0.699 . . . . 0.0 112.462 174.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 85.6 m -83.9 -19.85 34.04 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.816 0.847 . . . . 0.0 111.069 174.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 9.6 mt -87.45 -14.75 39.62 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.452 0.701 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -82.68 140.93 44.25 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.795 1.179 . . . . 0.0 109.749 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.81 164.91 17.45 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.421 2.747 . . . . 0.0 110.817 173.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -65.93 8.95 0.24 Allowed 'Trans proline' 0 CA--C 1.549 1.265 0 C-N-CA 124.871 3.714 . . . . 0.0 115.866 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.42 HD13 HD12 ' A' ' 474' ' ' LEU . 1.0 OUTLIER 90.49 -0.13 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 132.256 4.222 . . . . 0.0 113.535 175.118 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -34.52 -58.23 0.49 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.611 2.364 . . . . 0.0 115.724 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -98.07 2.76 49.07 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.42 HD12 HD13 ' A' ' 471' ' ' LEU . 80.8 mt -85.11 -65.66 0.98 Allowed 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.943 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 24.5 t0 57.88 118.8 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.446 1.898 . . . . 0.0 111.172 -173.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.92 -27.33 65.16 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.296 -1.502 . . . . 0.0 111.285 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -68.93 -23.58 64.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 117.548 -1.215 . . . . 0.0 112.206 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -84.93 -20.02 31.3 Favored 'General case' 0 C--N 1.348 0.529 0 CA-C-N 121.337 1.88 . . . . 0.0 111.393 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 546' ' ' LEU . 1.2 mt -128.98 91.85 41.46 Favored Pre-proline 0 C--O 1.235 0.318 0 CA-C-N 119.364 0.984 . . . . 0.0 111.309 -173.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.16 85.23 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 124.114 3.209 . . . . 0.0 111.618 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.03 -22.33 2.45 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 125.505 1.526 . . . . 0.0 112.066 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.74 -32.09 68.91 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.963 1.382 . . . . 0.0 110.524 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -53.05 -32.55 42.7 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.301 0.955 . . . . 0.0 113.836 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.481 HD21 HD21 ' A' ' 512' ' ' ASN . 1.6 tt -63.25 -44.35 95.42 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 119.584 1.692 . . . . 0.0 110.763 173.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -66.02 -39.6 90.36 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.671 0.789 . . . . 0.0 110.333 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.48 76.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 118.499 0.59 . . . . 0.0 110.255 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.94 -56.56 18.26 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.821 1.648 . . . . 0.0 108.186 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.57 -52.85 53.07 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.212 1.405 . . . . 0.0 111.964 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 468' ' ' VAL . 43.8 t -58.41 -42.49 84.29 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 CA-C-N 119.684 1.129 . . . . 0.0 109.931 178.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.58 -47.95 80.72 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.989 0.813 . . . . 0.0 109.818 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 94.2 m -63.0 -40.45 97.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.732 2.013 . . . . 0.0 110.51 176.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.5 m -64.64 -39.64 94.05 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 120.927 -1.108 . . . . 0.0 110.448 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.76 -16.86 64.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.966 0.906 . . . . 0.0 112.19 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.6 -41.16 12.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.739 1.615 . . . . 0.0 112.194 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -79.33 109.62 12.1 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 120.145 1.339 . . . . 0.0 110.1 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.75 108.96 2.68 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 121.217 1.278 . . . . 0.0 109.661 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.85 54.97 5.57 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.09 0.853 . . . . 0.0 111.705 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.1 165.76 8.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.93 168.31 20.06 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 176.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.4 m -49.24 -51.68 31.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.242 1.417 . . . . 0.0 110.152 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -79.37 -37.12 25.08 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -174.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.47 -31.43 72.58 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.253 0.621 . . . . 0.0 109.995 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 62.6 tp -60.48 -51.97 67.2 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 124.096 0.958 . . . . 0.0 110.349 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.44 -36.08 75.25 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 118.965 -0.54 . . . . 0.0 109.841 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.13 -38.95 75.69 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.318 0.508 . . . . 0.0 110.653 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -69.8 -21.22 63.42 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.663 0.665 . . . . 0.0 112.121 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -105.89 8.65 32.72 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.169 -1.582 . . . . 0.0 109.015 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -54.45 120.66 6.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 119.542 -1.974 . . . . 0.0 111.409 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 88.89 10.2 67.08 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.207 -0.774 . . . . 0.0 113.376 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.82 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.0 m -92.26 152.49 19.79 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.941 1.371 . . . . 0.0 108.028 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.17 -16.25 42.57 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 121.259 -0.901 . . . . 0.0 112.448 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.82 ' H ' HG22 ' A' ' 510' ' ' THR . 61.7 t30 -93.93 -15.12 25.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.133 0.973 . . . . 0.0 111.103 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -53.75 -49.31 68.45 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.079 0.854 . . . . 0.0 110.461 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.89 58.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.739 0.699 . . . . 0.0 112.581 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 90.7 m -66.29 -44.79 82.51 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.894 -0.504 . . . . 0.0 110.285 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.22 -37.59 88.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.425 0.69 . . . . 0.0 111.011 178.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -62.08 -49.34 76.34 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.695 1.998 . . . . 0.0 108.531 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -55.06 -42.04 72.22 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.57 0.748 . . . . 0.0 110.952 174.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 87.7 mt -79.24 -13.56 59.6 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.476 0.71 . . . . 0.0 112.332 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 5.5 t -75.5 -51.64 12.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.19 0.996 . . . . 0.0 108.814 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 1.3 ptm -87.45 33.26 0.69 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 127.14 2.176 . . . . 0.0 111.135 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -88.02 94.92 9.94 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.394 1.092 . . . . 0.0 113.269 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -62.71 -7.8 5.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 128.175 2.59 . . . . 0.0 113.364 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.08 -13.96 62.15 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.564 1.945 . . . . 0.0 112.153 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 2.5 pt -137.87 -60.36 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.234 1.814 . . . . 0.0 110.304 -176.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 53.85 0.86 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.92 3.288 . . . . 0.0 117.822 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . 0.535 ' CG ' ' H ' ' A' ' 528' ' ' LYS . 28.6 t70 -108.47 -173.84 2.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.759 1.163 . . . . 0.0 112.795 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.535 ' H ' ' CG ' ' A' ' 527' ' ' ASP . 0.0 OUTLIER -142.98 -25.84 0.6 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.284 2.634 . . . . 0.0 111.153 -174.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -82.67 -58.69 2.79 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 56.7 mt -55.87 -33.25 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.553 1.141 . . . . 0.0 108.463 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.99 -50.01 67.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.547 1.139 . . . . 0.0 112.531 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.56 -39.29 94.01 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.717 0.77 . . . . 0.0 110.17 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -68.59 -47.1 67.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.701 -0.624 . . . . 0.0 110.245 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 77.5 m -67.24 -27.27 67.08 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 112.154 175.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.509 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.6 t80 -65.03 -53.38 46.82 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 26.0 m -55.8 -44.54 77.9 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 124.44 1.096 . . . . 0.0 109.995 177.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.25 -45.88 82.78 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.9 t -64.89 -44.6 89.11 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.579 -0.7 . . . . 0.0 109.666 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 5.6 tt -56.51 -51.32 68.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.593 1.157 . . . . 0.0 109.776 174.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -61.6 -44.99 95.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.841 -178.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.43 -29.71 70.75 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.482 1.913 . . . . 0.0 109.872 175.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.01 -59.91 3.63 Favored 'General case' 0 C--N 1.342 0.243 0 O-C-N 120.735 -1.228 . . . . 0.0 107.787 173.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -59.35 -47.94 83.51 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 124.596 1.159 . . . . 0.0 110.527 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -50.16 -53.95 24.2 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 128.39 2.676 . . . . 0.0 109.479 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 16.7 t -67.3 -36.48 81.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.931 0.332 . . . . 0.0 111.588 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 479' ' ' LEU . 18.7 mt -65.93 -35.92 81.93 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 119.961 -1.712 . . . . 0.0 110.022 177.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 32.0 mt -71.65 -38.36 70.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.188 1.395 . . . . 0.0 110.003 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.57 -53.98 51.83 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 108.492 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 65.7 mt -56.73 -46.76 81.14 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.837 1.255 . . . . 0.0 110.223 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -63.72 -36.89 85.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 118.398 -0.81 . . . . 0.0 111.032 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.22 -52.88 63.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.03 -39.06 91.01 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.706 0.685 . . . . 0.0 109.998 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.04 -45.87 91.68 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.5 1.12 . . . . 0.0 111.014 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.321 0.4 OUTLIER -76.24 -34.25 59.2 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.222 -0.924 . . . . 0.0 110.648 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.5 mm -66.52 -34.53 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 119.612 1.096 . . . . 0.0 109.241 173.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.33 82.83 Favored 'General case' 0 CA--C 1.522 -0.102 0 O-C-N 120.424 -1.423 . . . . 0.0 109.892 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -68.64 -5.53 20.69 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.12 176.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 -50.51 11.13 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 121.206 1.821 . . . . 0.0 109.69 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -77.25 14.68 0.87 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.915 1.286 . . . . 0.0 113.916 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.521 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -143.28 -81.78 0.19 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.454 -0.779 . . . . 0.0 109.04 176.095 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.521 ' H ' HG23 ' A' ' 560' ' ' THR . 2.3 m170 -61.53 -40.88 96.26 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.079 1.351 . . . . 0.0 112.615 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 95.96 126.64 5.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.979 1.276 . . . . 0.0 111.735 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -73.64 166.01 24.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 173.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 16.3 m -103.53 166.53 10.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.61 -36.24 69.2 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.495 -173.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -76.46 -53.3 8.31 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.32 1.013 . . . . 0.0 109.348 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.43 -26.91 68.95 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.361 0.982 . . . . 0.0 113.199 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.465 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -72.85 -26.33 61.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.384 -1.447 . . . . 0.0 110.274 175.107 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.2 -27.16 28.21 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.721 1.608 . . . . 0.0 110.373 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -52.05 -41.58 62.42 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 173.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.465 HD12 ' HA ' ' A' ' 568' ' ' ARG . 4.2 mt -61.04 -37.53 82.93 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.028 -1.463 . . . . 0.0 113.806 177.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -49.68 76.89 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 121.014 1.734 . . . . 0.0 107.916 174.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.4 m -65.24 -44.99 86.42 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.615 0.572 . . . . 0.0 110.25 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -43.87 80.3 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.459 1.104 . . . . 0.0 110.65 175.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.91 -34.24 77.01 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 121.523 -0.736 . . . . 0.0 110.893 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.38 -37.87 77.76 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.986 0.812 . . . . 0.0 110.392 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -68.3 -32.03 71.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.263 0.483 . . . . 0.0 110.118 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.8 mt . . . . . 0 N--CA 1.466 0.352 0 O-C-N 121.121 -0.987 . . . . 0.0 110.205 176.821 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 4.5 tmm? . . . . . 0 N--CA 1.47 0.575 0 CA-C-O 123.386 1.565 . . . . 0.0 110.903 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -127.9 -48.55 1.36 Allowed 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 116.928 -1.511 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.565 HD12 ' CG2' ' A' ' 534' ' ' THR . 6.6 mm -61.15 -40.35 85.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.791 174.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.8 mt -62.31 -52.99 61.47 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 120.294 1.406 . . . . 0.0 109.907 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.593 HG23 HD13 ' A' ' 488' ' ' LEU . 73.5 mt -70.33 -55.33 14.91 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 117.787 -1.102 . . . . 0.0 110.86 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -49.22 -55.71 11.93 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.573 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -50.97 -46.68 61.34 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 117.175 -1.393 . . . . 0.0 113.412 174.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.3 tm? -61.95 -29.97 70.6 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 124.306 1.004 . . . . 0.0 111.345 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 22.2 t -67.81 -54.77 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 124.446 1.099 . . . . 0.0 109.126 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -74.6 -11.47 60.21 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.778 -0.576 . . . . 0.0 112.068 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.737 ' HB3' HD12 ' A' ' 464' ' ' LEU . 5.3 t-20 -142.33 78.05 17.04 Favored Pre-proline 0 N--CA 1.445 -0.71 0 CA-C-N 118.513 0.597 . . . . 0.0 110.297 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -65.57 -20.15 60.27 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 121.518 1.479 . . . . 0.0 111.206 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.55 -25.54 64.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.973 1.309 . . . . 0.0 111.509 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.737 HD12 ' HB3' ' A' ' 461' ' ' ASN . 25.9 mt -61.81 -15.09 38.9 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-N 119.285 0.948 . . . . 0.0 110.155 173.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 458' ' ' LEU . . . -61.65 -40.44 94.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.219 -0.925 . . . . 0.0 110.039 173.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 83.4 m -72.88 -17.93 61.47 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.882 -1.136 . . . . 0.0 111.348 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 3.5 mt -84.99 -27.68 26.29 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.267 1.027 . . . . 0.0 109.665 175.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -60.8 144.98 89.19 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.595 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.5 Cg_endo -69.86 168.55 21.37 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.165 1.91 . . . . 0.0 111.012 175.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -71.17 1.12 5.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.878 3.052 . . . . 0.0 114.004 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 474' ' ' LEU . 3.2 mp 72.95 58.76 0.11 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 129.396 3.079 . . . . 0.0 109.338 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.02 -37.08 29.74 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.322 -0.861 . . . . 0.0 110.938 -173.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.1 17.42 21.66 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 125.295 1.438 . . . . 0.0 112.291 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 471' ' ' LEU . 15.2 mt -106.41 -94.9 0.36 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.232 -1.366 . . . . 0.0 109.004 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 46.6 t0 78.92 142.99 0.08 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.376 2.271 . . . . 0.0 109.83 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.93 -19.37 62.59 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.135 -0.978 . . . . 0.0 109.805 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -59.92 -43.17 95.08 Favored 'General case' 0 C--N 1.341 0.212 0 O-C-N 121.078 -1.013 . . . . 0.0 110.07 174.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -32.58 43.97 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 118.878 -0.582 . . . . 0.0 110.42 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 482' ' ' LEU . 60.4 mt -131.9 96.2 20.85 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 125.839 1.655 . . . . 0.0 108.821 -174.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.28 1.95 3.68 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 123.428 2.752 . . . . 0.0 113.165 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -109.36 -13.53 16.95 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 120.99 -1.069 . . . . 0.0 111.838 174.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.656 HD23 ' O ' ' A' ' 482' ' ' LEU . 5.6 tt -61.06 -35.43 76.92 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 116.687 -1.625 . . . . 0.0 108.816 174.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -41.95 -46.56 5.09 Favored Glycine 0 N--CA 1.479 1.536 0 CA-C-N 119.746 1.157 . . . . 0.0 111.553 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 488' ' ' LEU . 0.2 OUTLIER -60.66 -49.12 78.8 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.581 0.752 . . . . 0.0 110.709 177.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -59.8 -46.11 90.24 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.243 1.017 . . . . 0.0 111.274 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -49.69 76.05 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 117.611 -1.185 . . . . 0.0 107.994 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.64 -39.65 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.996 0.918 . . . . 0.0 110.601 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.755 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.13 -54.1 50.8 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.833 1.253 . . . . 0.0 111.329 174.461 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 468' ' ' VAL . 88.8 t -60.04 -46.1 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 116.773 -1.584 . . . . 0.0 108.288 175.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -54.9 -50.06 69.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.377 1.871 . . . . 0.0 109.028 -175.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.6 m -58.0 -50.65 72.68 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.74 173.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.1 m -61.2 -36.86 81.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.685 1.584 . . . . 0.0 112.75 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -21.41 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 128.562 2.745 . . . . 0.0 110.974 173.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.32 -58.79 1.98 Allowed 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 117.658 -1.163 . . . . 0.0 108.669 173.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.596 ' HB3' HD13 ' A' ' 498' ' ' LEU . 97.2 mm-40 -46.24 93.06 0.05 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 128.345 2.658 . . . . 0.0 112.148 -173.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -73.16 119.84 6.25 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.653 2.235 . . . . 0.0 110.643 -173.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 66.32 36.99 92.44 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 495' ' ' GLN . 14.3 tp -61.7 160.94 10.76 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-O 121.216 0.531 . . . . 0.0 110.139 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.97 165.83 24.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 90.3 m -53.68 -41.64 67.1 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.381 1.473 . . . . 0.0 109.825 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.06 -40.81 11.01 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -62.74 -29.43 70.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.052 0.541 . . . . 0.0 111.552 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.09 -53.73 53.39 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.86 -37.3 71.11 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.38 0.536 . . . . 0.0 111.578 176.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.04 -40.53 87.18 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.163 -0.336 . . . . 0.0 111.085 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -66.72 -15.71 63.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.777 1.231 . . . . 0.0 111.917 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -116.87 16.23 15.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.906 1.682 . . . . 0.0 109.158 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -56.98 131.8 50.9 Favored 'General case' 0 C--N 1.34 0.172 0 O-C-N 120.465 -1.397 . . . . 0.0 108.936 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.62 74.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-O 119.683 -0.51 . . . . 0.0 112.456 173.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.805 HG22 ' H ' ' A' ' 512' ' ' ASN . 32.2 m -110.41 147.68 33.52 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.602 1.161 . . . . 0.0 108.485 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -61.09 -22.1 64.3 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 111.424 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.805 ' H ' HG22 ' A' ' 510' ' ' THR . 5.2 m-20 -92.26 -16.95 25.46 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 124.884 1.274 . . . . 0.0 109.775 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.55 68.03 Favored 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.58 -45.83 63.26 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.899 0.88 . . . . 0.0 112.589 178.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 52.9 m -66.27 -43.99 84.87 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.866 -0.521 . . . . 0.0 109.843 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.755 HD21 HD11 ' A' ' 488' ' ' LEU . 50.3 mt -61.73 -38.39 87.77 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.818 1.247 . . . . 0.0 111.808 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -71.07 -41.02 71.25 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 127.314 2.246 . . . . 0.0 109.399 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -61.38 -38.44 87.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 86.7 mt -78.55 -11.53 59.97 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.694 -0.669 . . . . 0.0 112.634 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 22.7 t -79.75 -55.69 4.82 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 119.186 0.903 . . . . 0.0 108.769 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -74.01 5.99 3.79 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.279 1.431 . . . . 0.0 113.256 176.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -61.56 126.35 27.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.628 -0.67 . . . . 0.0 110.362 -173.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -110.82 6.22 21.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.908 2.083 . . . . 0.0 109.823 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.59 -30.57 70.88 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.558 -1.339 . . . . 0.0 109.958 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.1 pt -113.31 -77.91 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 129.148 2.979 . . . . 0.0 110.824 -174.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.7 57.75 5.65 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.286 1.434 . . . . 0.0 111.295 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -145.84 179.47 7.43 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.519 -0.738 . . . . 0.0 110.183 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -128.48 -37.88 1.78 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.444 2.297 . . . . 0.0 110.545 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -79.32 -59.74 2.64 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.096 1.758 . . . . 0.0 108.962 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 32.1 mt -60.23 -24.77 31.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-O 117.852 -1.071 . . . . 0.0 108.253 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.6 -66.75 0.34 Allowed 'General case' 0 C--N 1.347 0.473 0 C-N-CA 125.012 1.325 . . . . 0.0 110.199 176.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -45.83 63.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.184 0.594 . . . . 0.0 110.274 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -62.65 -50.88 69.47 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.573 -176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . 0.565 ' CG2' HD12 ' A' ' 453' ' ' ILE . 9.7 m -61.01 -34.43 74.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 126.331 1.852 . . . . 0.0 110.867 176.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.452 ' CD1' HD13 ' A' ' 464' ' ' LEU . 78.9 t80 -63.1 -57.23 11.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.204 0.911 . . . . 0.0 109.593 178.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 43.8 m -60.0 -42.2 93.75 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.982 -1.009 . . . . 0.0 109.4 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -54.85 -47.11 74.58 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.483 1.513 . . . . 0.0 110.354 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.3 t -62.67 -56.19 19.98 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.851 1.66 . . . . 0.0 109.901 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.518 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -48.63 -57.26 6.5 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.805 177.353 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -54.76 -44.24 73.45 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 126.826 2.05 . . . . 0.0 109.801 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -60.75 -44.04 97.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.473 1.109 . . . . 0.0 111.621 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -56.97 11.65 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.453 ' CD1' HD21 ' A' ' 474' ' ' LEU . 27.1 m-85 -56.64 -48.51 77.37 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.417 0.448 . . . . 0.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -51.28 -53.98 30.45 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.328 1.851 . . . . 0.0 110.734 175.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 43.8 t -53.92 -44.42 70.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.95 -43.36 83.35 Favored 'General case' 0 C--O 1.225 -0.215 0 O-C-N 120.72 -1.238 . . . . 0.0 109.275 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.09 -48.52 78.4 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.405 1.482 . . . . 0.0 109.572 174.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.04 -54.4 42.0 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.425 1.09 . . . . 0.0 110.214 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 20.2 mt -54.7 -38.33 66.91 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 123.63 0.772 . . . . 0.0 109.558 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -65.37 -52.94 50.24 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -53.8 -51.05 64.73 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.517 1.127 . . . . 0.0 108.054 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.87 -41.1 99.26 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.027 -176.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -52.81 62.55 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 127.141 2.177 . . . . 0.0 109.863 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -58.15 -51.3 70.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.852 1.261 . . . . 0.0 108.835 -179.134 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.88 -37.31 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.729 -1.232 . . . . 0.0 110.217 175.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.25 -10.13 56.35 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 126.268 1.827 . . . . 0.0 111.057 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -96.75 9.45 41.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 116.704 -1.617 . . . . 0.0 109.642 173.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -100.57 -46.67 5.12 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.53 1.968 . . . . 0.0 111.198 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.13 -16.28 63.94 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.883 -1.136 . . . . 0.0 112.595 179.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.616 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.5 t -113.38 -105.33 0.39 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.616 ' H ' HG23 ' A' ' 560' ' ' THR . 1.2 m170 -44.15 -56.03 4.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 128.234 2.614 . . . . 0.0 113.159 -173.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 116.98 133.05 4.98 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 128.318 2.866 . . . . 0.0 108.303 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.2 mt -78.41 -171.27 2.36 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.9 m -137.19 171.83 13.9 Favored 'General case' 0 CA--C 1.498 -1.022 0 O-C-N 119.458 -2.026 . . . . 0.0 110.324 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.24 -48.18 74.31 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 113.248 -1.796 . . . . 0.0 109.05 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -72.91 -48.89 33.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.371 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -56.16 -43.34 78.26 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.147 0.579 . . . . 0.0 110.293 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -60.76 -37.57 82.3 Favored 'General case' 0 C--N 1.346 0.425 0 O-C-N 121.14 -0.975 . . . . 0.0 111.251 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.443 HD13 ' HD1' ' A' ' 572' ' ' TRP . 3.3 mm? -74.99 -33.46 61.84 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 122.836 0.455 . . . . 0.0 109.916 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -60.91 -40.71 94.2 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 120.443 -1.41 . . . . 0.0 107.586 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.7 mt -59.84 -41.98 92.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 116.654 -1.641 . . . . 0.0 110.475 173.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.444 ' CE3' ' HG2' ' A' ' 576' ' ' GLN . 0.0 OUTLIER -55.97 -51.41 67.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.261 1.846 . . . . 0.0 106.974 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -59.55 -38.17 80.36 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 125.554 1.784 . . . . 0.0 109.123 -173.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.18 -52.69 57.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.396 1.478 . . . . 0.0 111.46 176.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -61.03 -45.75 93.51 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.54 1.936 . . . . 0.0 110.804 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . 0.444 ' HG2' ' CE3' ' A' ' 572' ' ' TRP . 2.1 mp0 -67.43 -26.37 66.38 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 118.143 -0.932 . . . . 0.0 110.365 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -32.38 73.84 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.569 1.148 . . . . 0.0 110.559 173.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 CA--C 1.546 0.813 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 179.252 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.6 ptt? . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 112.842 0.682 . . . . 0.0 112.842 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -61.29 -31.95 71.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.39 -2.243 . . . . 0.0 111.662 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 13.1 mm -63.23 -52.41 58.99 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 121.124 1.783 . . . . 0.0 108.791 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 10.7 mt -53.13 -50.38 64.62 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.522 1.055 . . . . 0.0 110.432 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.623 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 mt -59.0 -59.71 3.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.329 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.82 99.45 Favored Glycine 0 C--O 1.223 -0.535 0 CA-C-N 119.939 1.245 . . . . 0.0 112.54 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 525' ' ' ILE . 1.0 OUTLIER -61.48 -43.51 98.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.565 -0.962 . . . . 0.0 108.619 177.095 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.511 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.1 tm? -65.79 -35.75 81.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.947 1.299 . . . . 0.0 111.373 175.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 455' ' ' ILE . 75.2 t -59.9 -56.3 18.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 O-C-N 120.994 -1.066 . . . . 0.0 108.3 174.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . 0.518 ' OE1' HG12 ' A' ' 459' ' ' VAL . 2.2 mp0 -75.39 -9.92 58.99 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.981 -0.45 . . . . 0.0 111.944 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.14 73.25 12.08 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 125.125 1.37 . . . . 0.0 109.894 -177.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.74 -19.99 59.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.782 2.321 . . . . 0.0 112.668 -174.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.29 -21.82 64.29 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.978 1.711 . . . . 0.0 110.153 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.425 HD13 ' CD1' ' A' ' 535' ' ' PHE . 76.5 mt -63.82 -13.51 45.1 Favored 'General case' 0 C--N 1.351 0.644 0 O-C-N 120.441 -1.412 . . . . 0.0 110.513 173.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.38 -32.64 74.37 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.122 0.874 . . . . 0.0 110.243 173.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.1 m -77.75 -17.35 57.64 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.783 -1.198 . . . . 0.0 110.943 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.79 -11.92 38.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 117.605 -1.188 . . . . 0.0 112.244 174.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 469' ' ' PRO . 2.4 p -94.5 151.28 39.18 Favored Pre-proline 0 CA--C 1.542 0.671 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.549 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.7 Cg_endo -72.77 177.72 7.26 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.42 2.747 . . . . 0.0 112.519 175.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.9 5.22 3.58 Favored 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.421 2.747 . . . . 0.0 114.643 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 474' ' ' LEU 0.254 1.8 mm? 71.18 47.81 0.39 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 129.342 3.057 . . . . 0.0 114.291 179.525 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -87.95 -20.09 26.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -173.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -106.05 -3.08 22.0 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.448 -1.407 . . . . 0.0 111.895 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.654 HD21 ' CE1' ' A' ' 543' ' ' PHE . 3.5 mp -109.1 -78.53 0.59 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 125.511 1.525 . . . . 0.0 108.508 -173.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 11.0 t70 62.61 162.73 0.09 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.121 1.768 . . . . 0.0 110.987 -173.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.8 -21.79 60.93 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.429 -1.419 . . . . 0.0 108.755 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -51.74 -43.29 62.84 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.159 2.584 . . . . 0.0 110.032 173.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -84.09 -49.7 8.65 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.477 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 13.0 mt -114.28 102.22 54.67 Favored Pre-proline 0 N--CA 1.47 0.556 0 C-N-CA 123.588 0.755 . . . . 0.0 112.034 -173.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.21 -26.03 15.18 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.56 2.174 . . . . 0.0 111.422 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -85.91 -15.98 64.19 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.646 -1.086 . . . . 0.0 112.656 174.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -25.55 65.22 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 119.021 1.41 . . . . 0.0 108.806 173.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.66 -48.35 7.38 Favored Glycine 0 C--O 1.218 -0.895 0 CA-C-N 119.85 1.205 . . . . 0.0 111.146 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -46.81 87.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.154 0.977 . . . . 0.0 110.677 176.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -59.74 -49.37 78.01 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.596 -0.69 . . . . 0.0 110.846 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -64.66 -44.85 89.1 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 124.881 1.272 . . . . 0.0 110.028 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.37 -49.45 76.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.753 1.221 . . . . 0.0 108.131 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.15 -51.33 70.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.342 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.49 HG11 ' CG1' ' A' ' 468' ' ' VAL . 38.6 t -56.69 -46.79 83.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 124.656 1.182 . . . . 0.0 109.935 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -58.32 -46.76 85.57 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.019 1.327 . . . . 0.0 108.587 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . 0.409 HG21 ' HE1' ' A' ' 507' ' ' TYR . 18.1 m -64.53 -39.68 94.21 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 124.188 0.995 . . . . 0.0 110.364 173.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.511 ' SG ' HD11 ' A' ' 458' ' ' LEU . 81.1 m -62.99 -41.96 99.71 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 120.777 1.626 . . . . 0.0 110.775 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.57 -22.84 67.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.667 1.587 . . . . 0.0 111.355 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.1 t -85.25 -50.44 7.36 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.752 0.821 . . . . 0.0 110.206 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -67.6 104.44 0.66 Allowed Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.3 1.84 . . . . 0.0 110.424 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -68.09 122.55 9.64 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.097 1.865 . . . . 0.0 110.018 -174.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.12 40.4 99.14 Favored Glycine 0 C--N 1.34 0.764 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 503' ' ' LEU . 34.8 tp -57.35 155.64 8.82 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.255 1.026 . . . . 0.0 110.662 175.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 2.4 p -143.0 163.36 32.99 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 37.4 m -50.41 -48.58 56.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.653 1.981 . . . . 0.0 110.431 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.6 17.36 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -59.89 -24.41 64.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.757 1.223 . . . . 0.0 111.569 176.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 498' ' ' LEU . 9.7 tp -61.66 -49.45 76.47 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 119.666 1.121 . . . . 0.0 110.097 175.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 517' ' ' GLU . 3.1 mp -64.25 -33.58 76.13 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.883 -0.579 . . . . 0.0 111.818 176.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -68.87 -45.78 70.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.734 0.814 . . . . 0.0 108.836 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -63.59 -17.17 62.58 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.952 -1.093 . . . . 0.0 113.04 174.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.5 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 20.5 m-85 -110.81 13.6 22.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.315 1.446 . . . . 0.0 109.1 177.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -56.19 129.45 40.22 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 119.576 -1.952 . . . . 0.0 109.133 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 78.64 8.2 87.79 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 118.979 -0.901 . . . . 0.0 113.967 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.787 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -92.5 146.85 23.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.058 1.429 . . . . 0.0 108.412 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -19.64 54.76 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 121.174 -0.954 . . . . 0.0 111.043 176.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.787 ' H ' HG22 ' A' ' 510' ' ' THR . 1.6 m-20 -94.22 -18.68 21.45 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.492 1.917 . . . . 0.0 111.508 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -49.96 -40.75 44.81 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.538 1.135 . . . . 0.0 110.608 176.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.61 66.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.461 2.304 . . . . 0.0 110.081 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . 0.545 HG22 HD11 ' A' ' 519' ' ' LEU . 6.8 m -58.51 -54.16 50.21 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 117.061 -1.447 . . . . 0.0 107.285 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 516' ' ' LEU . 2.6 mm? -53.95 -42.49 68.93 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.76 1.164 . . . . 0.0 110.878 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.605 ' HA ' HD21 ' A' ' 504' ' ' LEU . 6.3 tt0 -62.58 -46.71 87.1 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.304 1.842 . . . . 0.0 111.405 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -32.51 72.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.471 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.545 HD11 HG22 ' A' ' 515' ' ' THR . 31.4 mt -76.44 -22.74 54.24 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.169 174.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.1 t -65.17 -58.8 5.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 121.334 1.879 . . . . 0.0 111.824 -178.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.99 1.38 5.73 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.479 1.511 . . . . 0.0 113.517 175.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.53 ' CE3' HD11 ' A' ' 525' ' ' ILE . 2.7 t90 -71.46 86.15 0.85 Allowed 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.428 1.091 . . . . 0.0 109.591 -173.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.19 -12.7 19.36 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.719 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.63 -13.65 0.7 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 128.028 2.531 . . . . 0.0 114.159 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.702 HD13 ' CD2' ' A' ' 457' ' ' LEU . 4.3 mt -57.61 -78.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 C-N-CA 128.406 2.682 . . . . 0.0 111.685 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -171.28 -86.7 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 124.166 1.936 . . . . 0.0 114.165 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -157.84 158.15 34.61 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 127.048 2.139 . . . . 0.0 111.649 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -27.54 69.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 119.175 0.898 . . . . 0.0 112.746 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -71.36 -50.97 26.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.077 1.308 . . . . 0.0 109.416 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 10.5 mt -74.46 -4.17 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.584 1.554 . . . . 0.0 109.857 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.03 -63.35 1.33 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.553 1.07 . . . . 0.0 108.715 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -51.62 -43.75 62.68 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 122.7 0.4 . . . . 0.0 110.215 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -54.06 51.26 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.568 0.747 . . . . 0.0 111.399 175.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 57.8 m -57.23 -35.74 70.05 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.512 1.125 . . . . 0.0 110.641 176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.425 ' CD1' HD13 ' A' ' 464' ' ' LEU . 87.5 t80 -67.12 -57.9 5.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.095 0.862 . . . . 0.0 111.077 177.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.8 m -54.69 -45.03 73.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.069 -0.967 . . . . 0.0 109.183 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -62.0 -38.85 90.18 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.315 0.961 . . . . 0.0 110.575 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.6 t -62.98 -56.98 12.36 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.081 1.352 . . . . 0.0 110.672 174.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -49.09 -48.22 44.49 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.678 1.191 . . . . 0.0 108.19 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -57.9 -49.62 76.11 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -61.57 -35.27 77.32 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.777 1.231 . . . . 0.0 113.033 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.23 28.65 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 173.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.654 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.9 m-85 -59.89 -43.14 94.95 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.285 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.4 -51.64 66.17 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 110.206 174.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 14.8 t -52.08 -49.31 63.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.295 1.038 . . . . 0.0 110.194 173.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 474' ' ' LEU . 33.0 mt -67.13 -39.67 86.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.652 -174.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.63 -43.67 88.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 126.307 1.843 . . . . 0.0 109.696 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.06 -51.47 69.05 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 126.245 1.818 . . . . 0.0 109.298 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 4.5 mt -55.26 -51.6 66.11 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.74 1.216 . . . . 0.0 108.994 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.9 ttm-85 -58.82 -53.39 58.95 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.709 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -48.85 -51.81 27.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.827 1.251 . . . . 0.0 109.403 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.04 -38.53 82.63 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.467 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -50.83 70.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.106 1.762 . . . . 0.0 108.939 176.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.634 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.5 mt -57.9 -53.31 59.65 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.973 1.709 . . . . 0.0 108.96 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.5 -35.44 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 121.134 1.788 . . . . 0.0 109.985 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.17 -24.78 67.8 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.658 -1.276 . . . . 0.0 110.754 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -96.5 -1.54 47.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 116.179 -1.867 . . . . 0.0 109.773 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -43.11 14.2 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 122.974 2.625 . . . . 0.0 111.119 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -72.05 -3.76 24.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.601 2.36 . . . . 0.0 115.034 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.531 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -138.63 -89.31 0.22 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -176.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.531 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -48.49 -41.46 29.94 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.21 1.804 . . . . 0.0 112.054 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 72.36 80.04 0.42 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 109.08 -1.608 . . . . 0.0 109.08 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.45 158.27 0.29 Allowed 'General case' 0 C--O 1.238 0.487 0 O-C-N 124.937 1.022 . . . . 0.0 109.823 172.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.84 160.87 25.11 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.036 0.922 . . . . 0.0 110.489 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -37.84 74.22 Favored 'General case' 0 N--CA 1.458 -0.035 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.792 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.87 -53.34 57.08 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 125.717 1.607 . . . . 0.0 110.189 175.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -40.92 73.15 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.293 1.406 . . . . 0.0 112.457 174.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.46 ' HA ' HD12 ' A' ' 571' ' ' LEU . 20.3 ttm180 -63.1 -37.36 86.9 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.381 -1.45 . . . . 0.0 110.158 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.415 HD23 ' HD1' ' A' ' 572' ' ' TRP . 4.8 mt -71.13 -38.84 72.28 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.042 -1.456 . . . . 0.0 108.958 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -50.91 -44.12 59.96 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.424 1.011 . . . . 0.0 109.361 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.634 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.4 mt -56.58 -41.34 76.78 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 117.053 -1.451 . . . . 0.0 114.331 173.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.415 ' HD1' HD23 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -62.94 -45.66 91.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 121.982 2.174 . . . . 0.0 107.085 179.482 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -54.11 49.88 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -41.77 66.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.038 1.735 . . . . 0.0 111.825 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.22 -39.7 89.78 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.55 -1.344 . . . . 0.0 109.885 -177.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -74.7 -21.42 59.4 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.152 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -81.15 -34.63 32.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.485 1.514 . . . . 0.0 111.359 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.473 0.681 0 C-N-CA 124.959 1.304 . . . . 0.0 111.464 174.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.787 0 N-CA-C 112.963 0.727 . . . . 0.0 112.963 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -42.53 78.27 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 116.1 -1.905 . . . . 0.0 109.246 173.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.6 mm -58.24 -52.88 53.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.2 mt -50.88 -47.67 60.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 120.2 1.363 . . . . 0.0 110.264 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.571 HG23 HD13 ' A' ' 488' ' ' LEU . 56.5 mt -62.35 -58.07 9.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 124.969 1.307 . . . . 0.0 110.765 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -58.81 -37.52 90.51 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.885 2.183 . . . . 0.0 112.022 -177.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 81.1 mt -65.89 -41.95 90.9 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 117.523 -1.227 . . . . 0.0 108.838 173.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -30.3 68.19 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 120.202 1.365 . . . . 0.0 111.375 175.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.582 ' HA ' HD22 ' A' ' 503' ' ' LEU . 17.4 t -64.11 -54.8 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 124.582 1.153 . . . . 0.0 109.239 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -80.16 -10.12 59.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.916 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.61 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.5 t-20 -138.17 74.11 43.17 Favored Pre-proline 0 N--CA 1.448 -0.528 0 C-N-CA 123.371 0.668 . . . . 0.0 110.783 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.8 Cg_endo -65.55 -18.45 59.36 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.881 1.721 . . . . 0.0 112.066 -177.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.23 -20.68 61.51 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 123.839 0.856 . . . . 0.0 110.329 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.61 HD12 ' HB3' ' A' ' 461' ' ' ASN . 27.3 mt -62.68 -12.81 25.87 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.926 1.694 . . . . 0.0 110.029 176.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.87 74.54 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.015 0.926 . . . . 0.0 111.13 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 51.6 m -78.59 -17.04 56.69 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.685 1.13 . . . . 0.0 111.262 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.52 -23.37 22.06 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.753 1.221 . . . . 0.0 110.821 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.781 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -78.54 150.78 76.79 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 118.54 0.609 . . . . 0.0 109.464 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.781 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.6 Cg_endo -75.56 168.31 24.7 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.435 2.09 . . . . 0.0 112.124 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.49 3.87 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.703 3.602 . . . . 0.0 113.647 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 486' ' ' ARG . 3.2 mp 68.54 63.47 0.34 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.604 1.962 . . . . 0.0 110.739 176.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -89.74 -38.98 13.45 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.779 0.8 . . . . 0.0 111.138 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -108.39 0.56 21.19 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.452 2.701 . . . . 0.0 110.808 -176.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.58 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.7 mm? -84.16 -91.15 0.09 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.247 -2.872 . . . . 0.0 103.247 -177.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 41.6 t0 65.02 150.36 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.764 1.626 . . . . 0.0 110.72 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . 0.419 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 12.2 mt-10 -78.63 -17.97 55.21 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 120.147 -1.596 . . . . 0.0 109.072 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.33 -31.47 70.32 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.195 1.398 . . . . 0.0 111.216 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -94.93 -27.43 15.68 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.748 175.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 546' ' ' LEU . 3.0 mm? -125.06 89.01 53.34 Favored Pre-proline 0 C--O 1.237 0.433 0 CA-C-N 119.321 0.964 . . . . 0.0 110.801 -176.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.96 76.51 0.83 Allowed 'Trans proline' 0 CA--C 1.541 0.865 1 C-N-CA 125.962 4.442 . . . . 0.0 110.378 -175.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 144.7 -19.09 2.01 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.884 1.707 . . . . 0.0 113.905 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.94 -25.12 66.57 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 116.973 -1.489 . . . . 0.0 109.543 173.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . 0.419 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -44.22 -42.32 6.82 Favored Glycine 0 C--O 1.217 -0.928 0 CA-C-N 120.449 1.477 . . . . 0.0 110.763 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.519 HD23 HD13 ' A' ' 455' ' ' ILE . 33.1 tp -58.17 -51.09 71.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.554 1.177 . . . . 0.0 112.643 176.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.416 ' O ' HG23 ' A' ' 489' ' ' VAL . 80.0 t80 -58.2 -52.46 65.49 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 126.303 1.841 . . . . 0.0 110.79 173.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.571 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.1 OUTLIER -53.35 -51.58 62.01 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.671 1.588 . . . . 0.0 108.58 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.39 -42.42 83.37 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.23 1.412 . . . . 0.0 109.974 -176.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.571 HD13 HG23 ' A' ' 455' ' ' ILE . 0.2 OUTLIER -57.78 -48.69 78.95 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 124.481 1.112 . . . . 0.0 110.615 177.131 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 468' ' ' VAL . 84.5 t -63.62 -48.12 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 117.756 -1.116 . . . . 0.0 108.356 175.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -52.34 -41.65 63.21 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.117 1.326 . . . . 0.0 109.77 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.9 m -72.01 -42.16 66.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 126.513 1.925 . . . . 0.0 112.019 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.7 m -62.56 -39.77 94.73 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.199 1.363 . . . . 0.0 110.549 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -24.26 67.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.914 1.686 . . . . 0.0 111.975 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.58 -56.71 4.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.518 1.527 . . . . 0.0 107.997 174.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.9 100.0 0.23 Allowed Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 124.353 1.061 . . . . 0.0 111.267 -173.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.28 138.25 75.92 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 N-CA-C 107.274 -1.856 . . . . 0.0 107.274 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 55.93 36.61 67.36 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 124.528 1.061 . . . . 0.0 112.833 173.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 462' ' ' PRO . 7.2 tp -64.28 151.62 43.25 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.78 163.81 19.51 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.309 2.243 . . . . 0.0 107.665 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 91.6 m -58.57 -44.03 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.208 1.003 . . . . 0.0 111.18 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.46 -34.04 60.73 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -67.38 -29.0 68.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.616 1.208 . . . . 0.0 111.531 -177.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.582 HD22 ' HA ' ' A' ' 459' ' ' VAL . 13.8 tp -58.87 -51.96 67.78 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.65 -30.22 67.15 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.454 0.702 . . . . 0.0 111.569 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -71.86 -43.73 64.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.11 0.868 . . . . 0.0 112.468 176.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -63.86 -18.28 64.0 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.078 1.751 . . . . 0.0 111.859 173.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.521 ' CD2' HD13 ' A' ' 516' ' ' LEU . 69.1 m-85 -117.58 17.71 14.39 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.697 1.999 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -62.03 -19.22 62.65 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 121.357 1.89 . . . . 0.0 114.158 -176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -136.06 42.26 1.34 Allowed Glycine 0 C--O 1.227 -0.311 0 C-N-CA 124.996 1.284 . . . . 0.0 110.852 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.707 HG22 ' H ' ' A' ' 512' ' ' ASN . 48.7 m -108.09 145.99 33.26 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -21.35 65.39 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 121.217 -0.927 . . . . 0.0 112.011 174.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.707 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m-20 -88.95 -26.28 21.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 130.817 3.647 . . . . 0.0 109.675 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -40.49 -43.89 1.93 Allowed 'General case' 0 C--O 1.206 -1.203 0 C-N-CA 124.24 1.016 . . . . 0.0 110.426 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.77 -52.63 47.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.876 1.67 . . . . 0.0 113.217 176.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 89.7 m -63.73 -45.21 90.91 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 124.842 1.257 . . . . 0.0 109.693 174.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.521 HD13 ' CD2' ' A' ' 507' ' ' TYR . 42.9 mt -60.52 -34.52 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.292 1.037 . . . . 0.0 111.21 177.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -40.77 64.46 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 127.04 2.136 . . . . 0.0 109.412 -178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -64.55 -37.94 89.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.497 HD22 ' CE3' ' A' ' 522' ' ' TRP . 88.0 mt -77.32 -10.9 59.72 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 118.395 -0.812 . . . . 0.0 112.515 173.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 9.4 t -69.92 -66.04 0.64 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.192 1.397 . . . . 0.0 108.388 177.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.38 14.36 2.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.459 1.904 . . . . 0.0 111.742 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.678 ' CE3' HD11 ' A' ' 525' ' ' ILE . 4.4 t90 -53.69 123.97 13.8 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -28.62 15.55 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.281 -173.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -49.75 -30.26 9.12 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 125.502 1.521 . . . . 0.0 111.031 -177.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.678 HD11 ' CE3' ' A' ' 522' ' ' TRP . 1.6 pt -110.27 -70.84 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 130.834 3.654 . . . . 0.0 112.457 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.38 52.09 3.67 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 126.877 2.071 . . . . 0.0 112.311 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 531' ' ' ALA . 3.3 t70 -151.11 150.21 30.41 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.61 -174.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -106.88 -27.71 10.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.364 1.066 . . . . 0.0 111.983 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -87.66 -60.75 1.89 Allowed 'General case' 0 CA--C 1.51 -0.584 0 C-N-CA 124.567 1.147 . . . . 0.0 108.936 -177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 45.0 mt -55.55 -28.12 22.35 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 527' ' ' ASP . . . -50.69 -60.32 3.16 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.814 1.246 . . . . 0.0 111.206 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -52.74 -42.97 65.41 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 119.058 0.844 . . . . 0.0 110.602 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -49.48 69.64 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.31 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 61.2 m -58.94 -31.37 68.63 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.156 1.782 . . . . 0.0 107.75 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.524 ' CD1' HD13 ' A' ' 464' ' ' LEU . 39.4 t80 -66.55 -58.05 6.0 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 109.551 178.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 80.6 m -63.23 -39.6 95.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.706 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -60.02 -45.18 93.62 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.467 1.107 . . . . 0.0 108.361 175.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.7 t -70.4 -51.77 27.23 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.479 -1.388 . . . . 0.0 112.002 -176.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.3 tt -46.8 -49.94 19.13 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 126.708 2.003 . . . . 0.0 111.083 170.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.267 0.9 OUTLIER -65.68 -33.56 76.18 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-O 116.04 -1.933 . . . . 0.0 110.342 179.071 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -72.04 -35.45 69.35 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.049 1.295 . . . . 0.0 110.36 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -57.72 9.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.58 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.5 m-85 -58.76 -42.38 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 126.487 1.915 . . . . 0.0 111.343 -177.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.68 -49.14 78.66 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 127.551 2.341 . . . . 0.0 109.096 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.6 t -56.59 -35.62 68.44 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.626 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 479' ' ' LEU . 16.2 mt -74.0 -40.82 62.67 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.712 1.205 . . . . 0.0 111.087 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 30.8 mt -61.7 -44.86 96.13 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 117.517 -1.23 . . . . 0.0 109.0 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.046 0.938 . . . . 0.0 111.476 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . 0.564 HD23 ' N ' ' A' ' 550' ' ' ARG . 0.2 OUTLIER -54.33 -45.55 72.69 Favored 'General case' 0 CA--C 1.451 -2.85 0 C-N-CA 124.493 1.117 . . . . 0.0 111.346 173.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . 0.564 ' N ' HD23 ' A' ' 549' ' ' LEU . 1.3 ttm-85 -63.98 -51.07 66.01 Favored 'General case' 0 C--N 1.272 -2.777 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.69 -51.95 52.04 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.654 1.182 . . . . 0.0 109.149 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.89 -43.24 99.26 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.063 -176.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -40.21 95.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.196 1.798 . . . . 0.0 110.373 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 571' ' ' LEU . 4.2 mt -60.72 -55.13 36.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.697 1.199 . . . . 0.0 107.835 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.9 mm -61.57 -39.54 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 120.255 1.389 . . . . 0.0 111.763 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -60.25 -18.29 47.87 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.503 1.521 . . . . 0.0 109.542 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.18 18.49 12.19 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 120.577 1.535 . . . . 0.0 111.39 173.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.85 -63.83 1.4 Allowed 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 121.164 1.802 . . . . 0.0 109.523 177.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -8.8 53.51 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.181 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.05 -43.01 3.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.358 1.435 . . . . 0.0 109.886 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -115.06 -74.18 0.62 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.495 1.518 . . . . 0.0 109.09 -173.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 148.62 109.18 0.52 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -79.78 132.74 36.22 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.3 t -66.57 165.32 14.86 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.88 -39.9 86.87 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.759 . . . . 0.0 110.624 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.73 -51.56 26.56 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 123.995 0.918 . . . . 0.0 109.343 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -59.0 -30.4 67.96 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 123.793 1.759 . . . . 0.0 111.526 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.97 -38.37 72.78 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 118.785 -2.447 . . . . 0.0 106.147 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 18.4 mt -67.76 -32.9 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.487 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.5 -43.55 62.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.131 1.332 . . . . 0.0 108.912 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.0 OUTLIER -61.78 -39.84 93.1 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 117.423 -1.275 . . . . 0.0 112.803 177.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -50.48 72.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.166 1.803 . . . . 0.0 108.172 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -35.91 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 124.146 0.904 . . . . 0.0 109.404 -175.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -52.61 37.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.789 1.636 . . . . 0.0 110.95 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -57.4 -46.22 83.7 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.464 1.906 . . . . 0.0 111.468 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.8 -24.72 65.33 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 111.66 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.21 -33.89 43.36 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 119.257 0.935 . . . . 0.0 109.346 173.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.476 0.875 0 C-N-CA 128.024 2.53 . . . . 0.0 109.869 -176.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 46.5 ttm . . . . . 0 N--CA 1.463 0.215 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -56.02 -19.23 11.85 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.26 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.4 mm -51.99 -52.14 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 125.167 1.387 . . . . 0.0 109.409 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.54 -42.71 67.76 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.494 0.588 . . . . 0.0 111.517 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.527 HG23 HD22 ' A' ' 488' ' ' LEU . 43.8 mt -69.39 -53.08 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.227 0.611 . . . . 0.0 109.553 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -64.18 -43.43 97.12 Favored Glycine 0 C--N 1.336 0.534 0 CA-C-N 118.749 0.704 . . . . 0.0 112.679 -173.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.22 -41.68 96.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.154 177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.411 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.4 tm? -64.77 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.83 0.741 . . . . 0.0 110.68 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.63 -50.96 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 121.599 -0.688 . . . . 0.0 109.541 173.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -72.59 -28.63 62.91 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.293 -174.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -133.55 84.47 45.61 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 126.895 2.078 . . . . 0.0 111.643 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -65.36 -21.48 61.03 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 121.945 1.763 . . . . 0.0 113.3 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.64 -17.02 62.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.069 0.849 . . . . 0.0 111.278 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.41 -15.58 58.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.207 -0.933 . . . . 0.0 110.673 173.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.77 -25.47 67.27 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 119.452 1.024 . . . . 0.0 111.047 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 7.9 m -83.41 -12.82 56.01 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.066 0.946 . . . . 0.0 110.789 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 20.8 mt -103.17 -7.55 21.15 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 112.478 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -92.32 137.89 24.5 Favored Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 119.995 1.27 . . . . 0.0 109.692 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.05 164.72 24.0 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.17 2.58 . . . . 0.0 110.355 173.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.72 16.57 0.27 Allowed 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 123.474 2.783 . . . . 0.0 115.515 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.543 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.5 mm? 69.38 16.4 8.3 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 128.367 2.667 . . . . 0.0 113.249 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -57.79 -20.26 34.11 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.129 2.572 . . . . 0.0 115.396 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.3 10.08 19.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.34 1.456 . . . . 0.0 111.826 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.1 mp -124.13 -58.21 1.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.047 0.939 . . . . 0.0 111.731 -173.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 25.8 t0 64.59 157.25 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.533 1.533 . . . . 0.0 108.866 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -75.27 -21.96 58.14 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 119.711 -1.868 . . . . 0.0 107.576 173.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -61.8 -49.21 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.291 2.237 . . . . 0.0 113.202 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 48.0 mmtt -77.21 -20.31 55.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.715 -0.659 . . . . 0.0 112.497 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -120.78 88.29 43.69 Favored Pre-proline 0 N--CA 1.453 -0.282 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.53 87.95 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.99 2.46 . . . . 0.0 111.307 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.46 -19.02 2.82 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.276 1.893 . . . . 0.0 112.589 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 8.7 tt -62.77 -25.1 68.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.822 1.311 . . . . 0.0 111.499 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.66 -40.06 17.12 Favored Glycine 0 CA--C 1.527 0.822 0 CA-C-N 118.607 0.64 . . . . 0.0 112.054 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.462 HD13 HD21 ' A' ' 512' ' ' ASN . 18.1 tp -63.89 -40.91 97.62 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.735 1.267 . . . . 0.0 112.696 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -61.86 -42.59 99.23 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.716 -1.24 . . . . 0.0 109.074 174.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -61.91 -47.56 84.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.294 1.038 . . . . 0.0 110.76 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.23 -56.44 14.67 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 127.238 2.215 . . . . 0.0 109.473 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 455' ' ' ILE . 2.8 mp -56.25 -59.68 4.59 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.586 1.155 . . . . 0.0 109.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 468' ' ' VAL . 72.6 t -54.68 -42.86 63.38 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.164 0 C-N-CA 123.361 0.664 . . . . 0.0 109.628 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -59.64 -44.8 93.36 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 119.131 0.878 . . . . 0.0 110.798 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.5 m -63.76 -41.61 97.96 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 123.503 0.721 . . . . 0.0 109.898 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 458' ' ' LEU . 88.5 m -62.97 -44.49 95.91 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 119.002 0.819 . . . . 0.0 110.074 -177.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -18.46 47.05 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.748 1.219 . . . . 0.0 112.817 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.8 t -99.46 -11.84 20.73 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.901 1.68 . . . . 0.0 113.023 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -106.29 90.69 4.95 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 125.234 1.414 . . . . 0.0 109.791 -176.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.23 122.7 10.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.845 1.697 . . . . 0.0 110.082 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 75.41 30.45 58.48 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 119.481 -0.622 . . . . 0.0 112.406 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 37.9 tp -56.07 153.3 9.18 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.81 0.805 . . . . 0.0 110.065 174.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -136.29 166.61 23.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.4 m -47.02 -49.99 20.15 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.098 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.32 -33.46 19.98 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -64.63 -27.19 68.77 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.373 0.669 . . . . 0.0 110.356 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.5 -48.65 74.38 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.358 0.663 . . . . 0.0 109.999 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.7 mp -62.67 -31.11 71.94 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.969 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -68.62 -48.84 63.07 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.693 0.679 . . . . 0.0 109.711 173.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -65.83 -20.66 66.32 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.688 -0.632 . . . . 0.0 112.349 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -107.11 8.81 30.39 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.977 0.911 . . . . 0.0 110.773 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.24 -14.88 12.43 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -173.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -118.54 12.29 12.27 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.722 1.153 . . . . 0.0 113.67 174.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.795 HG22 ' H ' ' A' ' 512' ' ' ASN . 90.8 m -94.06 146.97 23.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 119.849 1.825 . . . . 0.0 110.652 -174.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -9.87 9.8 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.396 1.078 . . . . 0.0 112.7 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.795 ' H ' HG22 ' A' ' 510' ' ' THR . 2.2 t-20 -94.82 -16.51 22.89 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.962 2.105 . . . . 0.0 112.201 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.45 -48.06 7.15 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.626 1.17 . . . . 0.0 113.232 -175.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.08 -43.92 87.29 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.311 0.505 . . . . 0.0 111.876 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.3 m -66.87 -37.91 85.32 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.722 -0.611 . . . . 0.0 110.726 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.37 -45.33 73.09 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.29 1.036 . . . . 0.0 110.965 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.24 -44.76 95.82 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -60.98 -35.39 76.68 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.857 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 39.8 mt -74.94 -27.14 60.07 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.412 1.46 . . . . 0.0 112.832 175.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 1.2 t -62.64 -47.23 84.63 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.86 12.99 11.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.635 1.574 . . . . 0.0 114.188 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -65.91 125.45 25.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.851 0.834 . . . . 0.0 111.732 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -81.44 -25.17 36.35 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 130.979 3.712 . . . . 0.0 114.308 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.64 -20.15 65.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.544 0.737 . . . . 0.0 112.331 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 4.9 pt -125.76 -64.62 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.268 1.027 . . . . 0.0 110.692 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 50.38 3.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 129.823 3.249 . . . . 0.0 118.179 174.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -114.92 164.84 13.57 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.724 1.147 . . . . 0.0 110.798 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.2 pttt -118.3 -13.43 9.84 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.942 1.697 . . . . 0.0 113.097 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.67 -53.56 4.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 120.44 1.473 . . . . 0.0 108.394 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.11 -24.39 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.149 1.779 . . . . 0.0 109.213 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.54 -45.34 66.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.455 1.102 . . . . 0.0 112.316 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -63.06 -51.6 66.03 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.364 0.984 . . . . 0.0 109.155 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -55.19 -44.76 75.59 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.378 0.671 . . . . 0.0 110.469 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.6 m -71.58 -29.69 65.0 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.652 0.781 . . . . 0.0 111.423 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -69.04 -51.42 39.21 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.69 1.132 . . . . 0.0 108.09 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 82.6 m -54.17 -45.45 72.09 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.305 1.042 . . . . 0.0 109.39 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -62.79 -47.72 82.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.043 0.838 . . . . 0.0 110.813 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -43.73 79.82 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.94 -52.52 62.71 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.991 0.917 . . . . 0.0 108.574 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -58.55 -45.11 89.63 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.963 0.905 . . . . 0.0 110.681 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -69.42 -35.04 75.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 119.414 1.006 . . . . 0.0 110.688 -179.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -56.05 24.71 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 173.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 10.7 m-85 -61.97 -48.34 80.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.931 0.893 . . . . 0.0 110.474 -176.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -55.67 -42.13 74.68 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.035 2.134 . . . . 0.0 111.787 176.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.8 t -67.08 -39.49 86.83 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.49 0.716 . . . . 0.0 111.764 174.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 41.8 mt -68.23 -38.37 81.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.434 -0.791 . . . . 0.0 109.908 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -46.35 88.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 109.001 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -64.2 -43.25 95.61 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.405 0.682 . . . . 0.0 111.131 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.84 -49.22 77.14 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.948 -1.095 . . . . 0.0 111.203 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 38.4 ttt-85 -57.8 -40.41 79.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 124.456 1.102 . . . . 0.0 109.668 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -56.09 -49.21 74.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.248 174.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -66.88 -36.98 83.55 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.048 1.295 . . . . 0.0 111.41 -175.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -55.19 -52.36 63.58 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.209 1.404 . . . . 0.0 109.766 174.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.474 ' HB3' HD11 ' A' ' 571' ' ' LEU . 13.8 mt -60.86 -55.42 33.22 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.11 0.964 . . . . 0.0 110.332 177.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.443 ' CD1' HD13 ' A' ' 571' ' ' LEU . 26.5 mm -63.61 -31.81 54.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 O-C-N 121.726 -0.609 . . . . 0.0 109.972 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.36 97.5 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.306 0.957 . . . . 0.0 109.927 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -69.06 -23.83 64.09 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 116.368 -1.777 . . . . 0.0 110.968 173.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.08 -41.0 74.67 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.795 2.543 . . . . 0.0 109.863 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -75.91 5.1 6.94 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -174.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.18 -79.98 0.14 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 119.176 0.898 . . . . 0.0 109.633 175.093 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.48 ' H ' HG23 ' A' ' 560' ' ' THR . 5.8 t-80 -47.39 -48.12 26.17 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 127.666 2.386 . . . . 0.0 113.662 -173.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 84.99 87.53 0.91 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 -173.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.3 172.52 11.03 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.78 158.7 24.18 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.268 0.627 . . . . 0.0 110.001 -175.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.46 -41.14 89.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.317 0.58 . . . . 0.0 109.44 174.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . 0.495 ' CD ' ' H ' ' A' ' 566' ' ' GLU . 23.5 mp0 -57.08 -52.9 63.44 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 129.068 2.947 . . . . 0.0 107.784 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -62.61 -39.94 95.38 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.554 1.542 . . . . 0.0 111.394 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -69.73 -23.75 63.44 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.177 -1.577 . . . . 0.0 110.271 177.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 57.0 mt -84.52 -38.99 19.37 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.145 1.378 . . . . 0.0 110.26 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -50.95 -44.49 60.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.844 1.202 . . . . 0.0 108.619 174.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 568' ' ' ARG . 17.5 mt -53.55 -40.95 65.96 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.999 0.92 . . . . 0.0 112.874 174.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 121.102 1.774 . . . . 0.0 109.21 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.2 m -56.69 -52.96 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.476 1.11 . . . . 0.0 108.776 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.9 tp -52.81 -47.95 67.26 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.561 1.545 . . . . 0.0 111.042 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -60.23 -37.82 81.52 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.711 0.804 . . . . 0.0 112.31 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -80.03 -35.74 36.8 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.426 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.76 -31.89 72.1 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.566 0.746 . . . . 0.0 109.9 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 32.1 mt . . . . . 0 C--N 1.33 -0.256 0 C-N-CA 124.071 0.948 . . . . 0.0 110.638 178.255 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptm . . . . . 0 N--CA 1.453 -0.281 0 CA-C-O 120.482 0.182 . . . . 0.0 111.037 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 23.5 mtt85 -74.9 -21.99 58.89 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.535 1.147 . . . . 0.0 110.34 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.504 HD13 ' HA ' ' A' ' 453' ' ' ILE . 1.8 mm -75.14 -45.43 41.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.506 1.129 . . . . 0.0 109.346 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.536 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 4.1 mm? -59.14 -47.23 86.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.578 1.174 . . . . 0.0 109.298 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.578 HG22 HD13 ' A' ' 519' ' ' LEU . 24.3 mt -72.79 -54.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.134 . . . . 0.0 109.265 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -45.46 -49.27 11.36 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.552 1.157 . . . . 0.0 111.005 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.726 HD11 HG22 ' A' ' 534' ' ' THR . 38.3 mt -66.1 -42.7 88.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.452 0.737 . . . . 0.0 109.33 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 465' ' ' ALA . 1.9 tm? -64.81 -26.91 68.55 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.517 1.136 . . . . 0.0 109.372 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.494 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 3.6 t -69.56 -52.56 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.446 1.091 . . . . 0.0 109.342 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . 0.407 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 4.4 mt-30 -75.49 -27.45 58.81 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.477 1.11 . . . . 0.0 110.23 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.739 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.3 OUTLIER -129.6 90.04 45.01 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.513 1.133 . . . . 0.0 109.269 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 -13.81 21.2 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.451 1.764 . . . . 0.0 111.028 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -77.11 -9.41 58.72 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.497 1.123 . . . . 0.0 110.311 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.766 HD22 ' CD2' ' A' ' 535' ' ' PHE . 18.7 mt -75.7 -15.16 60.33 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.443 1.089 . . . . 0.0 109.269 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.645 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -62.01 -31.53 71.92 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.517 1.136 . . . . 0.0 109.342 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 2.6 m -76.72 -13.22 60.06 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.53 1.144 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.689 HD12 HD23 ' A' ' 464' ' ' LEU . 19.5 mt -97.07 -9.12 28.69 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.53 1.144 . . . . 0.0 109.232 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.852 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.5 OUTLIER -97.62 146.43 31.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.483 1.114 . . . . 0.0 109.322 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.3 Cg_endo -75.01 175.29 11.44 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 124.457 1.767 . . . . 0.0 111.034 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 471' ' ' LEU . 18.5 Cg_endo -74.96 5.29 4.05 Favored 'Trans proline' 0 C--N 1.358 1.075 0 O-C-N 124.488 1.783 . . . . 0.0 111.018 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 1.021 ' CD1' HD12 ' A' ' 474' ' ' LEU . 3.4 mm? 68.63 70.49 0.29 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.484 1.115 . . . . 0.0 109.301 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.68 -62.51 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 0.0 110.296 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.88 -1.39 34.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.125 . . . . 0.0 109.319 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 1.021 HD12 ' CD1' ' A' ' 471' ' ' LEU . 7.6 mt -90.88 -61.97 1.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 1.191 . . . . 0.0 109.261 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 15.8 t0 60.77 152.81 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.498 1.124 . . . . 0.0 109.215 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -90.42 15.84 9.92 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.468 1.105 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -111.65 -34.04 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.49 1.119 . . . . 0.0 109.328 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -81.05 -21.17 40.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 0.0 109.317 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.458 ' CB ' ' HB2' ' A' ' 482' ' ' LEU . 46.4 mt -126.03 106.03 25.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.547 1.154 . . . . 0.0 109.313 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 73.98 4.17 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.502 1.79 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 152.18 -21.38 0.86 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.895 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.85 ' O ' HD13 ' A' ' 482' ' ' LEU . 2.1 tm? -54.3 -35.82 63.03 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 0.78 . . . . 0.0 109.336 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.29 -50.97 9.52 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.508 1.13 . . . . 0.0 111.047 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.47 -46.49 73.37 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.447 0.734 . . . . 0.0 109.348 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.536 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 46.8 t80 -65.55 -40.35 92.75 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.448 ' HB2' ' CD1' ' A' ' 482' ' ' LEU . 2.8 ttt85 -66.52 -49.12 67.56 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.511 1.132 . . . . 0.0 110.333 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.6 -47.22 80.09 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.495 1.122 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 1.009 HD11 HD21 ' A' ' 516' ' ' LEU . 1.4 mt -63.42 -49.69 72.74 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.507 1.129 . . . . 0.0 109.279 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.78 HG11 HG11 ' A' ' 468' ' ' VAL . 17.5 t -58.66 -49.75 81.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.529 1.143 . . . . 0.0 109.338 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -53.96 -39.38 65.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.474 1.109 . . . . 0.0 109.338 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . 0.477 HG23 HE22 ' A' ' 495' ' ' GLN . 1.1 m -73.71 -44.19 57.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.117 . . . . 0.0 110.384 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.419 ' HA ' HD22 ' A' ' 498' ' ' LEU . 66.5 m -56.1 -46.43 79.1 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.508 1.13 . . . . 0.0 108.227 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -22.19 43.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.508 1.13 . . . . 0.0 109.279 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.19 -53.25 5.91 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.572 1.17 . . . . 0.0 109.998 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.573 ' OE1' ' CD2' ' A' ' 506' ' ' HIS . 2.1 mp0 -61.51 110.99 3.62 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.433 1.083 . . . . 0.0 110.285 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 126.25 9.83 Favored 'Trans proline' 0 C--N 1.36 1.135 0 O-C-N 124.47 1.774 . . . . 0.0 110.919 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.06 41.32 99.84 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 124.479 1.112 . . . . 0.0 110.969 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.894 HD21 HD13 ' A' ' 503' ' ' LEU . 43.2 tp -58.46 164.87 2.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.54 0.788 . . . . 0.0 109.387 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 503' ' ' LEU . 6.3 p -142.95 170.51 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.46 1.1 . . . . 0.0 110.403 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 460' ' ' GLN . 2.3 m -66.56 -35.05 79.27 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.44 1.087 . . . . 0.0 110.372 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -83.92 -55.06 2.88 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.479 1.112 . . . . 0.0 111.033 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -50.81 -29.65 12.2 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.459 0.741 . . . . 0.0 110.287 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.894 HD13 HD21 ' A' ' 498' ' ' LEU . 21.9 tp -56.05 -58.81 6.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 0.0 109.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -56.98 -34.57 68.23 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.409 1.068 . . . . 0.0 109.357 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -64.32 -34.52 78.34 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . 0.573 ' CD2' ' OE1' ' A' ' 495' ' ' GLN . 68.8 t60 -71.69 -13.55 61.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 0.0 109.538 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.762 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 37.6 m-85 -124.22 27.24 7.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 0.0 111.071 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.26 126.98 31.21 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.507 1.129 . . . . 0.0 110.352 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.12 29.11 57.27 Favored Glycine 0 CA--C 1.529 0.947 0 O-C-N 124.453 1.095 . . . . 0.0 111.002 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.852 HG22 ' H ' ' A' ' 512' ' ' ASN . 19.0 m -109.02 136.78 47.97 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 0.763 . . . . 0.0 110.373 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 57.4 m-20 -58.75 -15.7 13.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.0 109.288 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.852 ' H ' HG22 ' A' ' 510' ' ' THR . 0.6 OUTLIER -97.41 -22.42 16.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.483 1.115 . . . . 0.0 109.268 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . 0.762 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.54 -36.08 9.93 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 0.0 109.263 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.49 41.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.452 1.095 . . . . 0.0 109.291 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 68.6 m -58.32 -42.42 86.7 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.461 1.1 . . . . 0.0 110.361 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 1.009 HD21 HD11 ' A' ' 488' ' ' LEU . 13.6 mt -66.56 -33.64 76.13 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.408 1.067 . . . . 0.0 109.335 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -68.21 -47.72 67.12 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.477 1.111 . . . . 0.0 110.277 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -56.21 -38.64 71.29 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 1.146 . . . . 0.0 109.332 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 455' ' ' ILE . 94.5 mt -72.4 -21.73 61.23 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.478 1.111 . . . . 0.0 109.31 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.9 t -68.74 -59.33 3.18 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 0.0 110.071 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . 0.403 ' O ' ' C ' ' A' ' 522' ' ' TRP . 0.3 OUTLIER -77.38 2.18 16.72 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.458 1.099 . . . . 0.0 111.009 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.654 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.9 t90 -42.07 137.67 1.8 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.146 . . . . 0.0 107.918 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.56 1.89 8.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -66.77 -24.3 66.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.488 1.117 . . . . 0.0 109.402 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.654 HD11 ' CE3' ' A' ' 522' ' ' TRP . 0.7 OUTLIER -113.46 -59.81 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.484 1.115 . . . . 0.0 109.239 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.36 61.76 2.09 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.448 1.092 . . . . 0.0 109.31 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . 0.556 ' OD2' HD12 ' A' ' 530' ' ' ILE . 3.7 t70 -161.94 153.21 18.25 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.559 1.162 . . . . 0.0 109.325 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.414 ' O ' ' HB3' ' A' ' 531' ' ' ALA . 8.1 pttt -115.93 -36.98 3.98 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.609 1.193 . . . . 0.0 109.29 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.53 -43.68 38.24 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.426 1.079 . . . . 0.0 109.291 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . 0.556 HD12 ' OD2' ' A' ' 527' ' ' ASP . 55.0 mt -70.91 -12.39 16.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.461 1.101 . . . . 0.0 109.345 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 457' ' ' LEU . . . -61.36 -58.19 9.24 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.44 1.088 . . . . 0.0 109.295 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -53.47 -48.07 69.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.411 1.069 . . . . 0.0 110.299 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -43.63 93.85 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.459 1.1 . . . . 0.0 110.304 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . 0.726 HG22 HD11 ' A' ' 457' ' ' LEU . 3.7 m -66.47 -36.08 81.87 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.429 1.08 . . . . 0.0 110.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.766 ' CD2' HD22 ' A' ' 464' ' ' LEU . 18.9 t80 -61.51 -51.6 67.96 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.565 1.166 . . . . 0.0 111.033 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 53.8 m -64.61 -46.91 80.6 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.517 1.136 . . . . 0.0 110.345 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -58.37 -41.18 84.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.533 1.145 . . . . 0.0 109.286 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.7 t -69.8 -56.49 7.0 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.992 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.611 HD11 HG23 ' A' ' 468' ' ' VAL . 0.7 OUTLIER -48.36 -43.54 33.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.483 1.114 . . . . 0.0 109.268 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.14 -38.26 90.42 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.496 1.122 . . . . 0.0 109.321 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.6 t-80 -62.71 -46.6 87.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.558 1.161 . . . . 0.0 109.601 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . 0.412 ' O ' ' HG ' ' A' ' 546' ' ' LEU . 1.1 ttp -63.48 -44.9 93.08 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.478 1.111 . . . . 0.0 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.909 ' HA ' HD12 ' A' ' 546' ' ' LEU . 5.8 m-85 -68.84 -35.13 76.57 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.526 1.141 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.01 -44.85 83.56 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.52 1.138 . . . . 0.0 109.258 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.2 t -52.98 -37.65 61.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 0.0 109.994 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.909 HD12 ' HA ' ' A' ' 543' ' ' PHE . 1.2 mt -72.11 -50.58 26.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 0.0 109.234 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.409 HD22 HD11 ' A' ' 574' ' ' LEU . 79.1 mt -53.53 -36.15 61.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.542 1.151 . . . . 0.0 109.233 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -59.02 -55.33 36.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.8 -44.12 94.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.531 1.145 . . . . 0.0 109.304 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -48.85 62.59 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.527 1.142 . . . . 0.0 110.378 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . 0.543 ' HG3' HD23 ' A' ' 571' ' ' LEU . 27.1 tt0 -52.44 -45.7 66.11 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.528 1.142 . . . . 0.0 110.338 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.94 -47.76 79.2 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.548 1.155 . . . . 0.0 110.306 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -33.74 73.86 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.534 1.146 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.849 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.4 OUTLIER -69.87 -50.28 44.05 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 0.0 109.216 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 571' ' ' LEU . 28.0 mm -64.25 -30.6 50.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 124.523 1.139 . . . . 0.0 109.248 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' A' ' 560' ' ' THR . . . -57.14 -19.28 19.23 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.488 1.117 . . . . 0.0 109.346 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . 0.631 ' C ' HD23 ' A' ' 563' ' ' LEU . 7.8 mmt85 -104.44 3.43 32.17 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.546 1.154 . . . . 0.0 110.293 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . 0.587 ' HB2' HD21 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -104.86 -21.45 13.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.474 1.109 . . . . 0.0 110.298 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -108.83 7.62 26.26 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.609 1.193 . . . . 0.0 110.203 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 556' ' ' ALA . 16.9 p -114.01 -61.71 1.7 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.48 1.113 . . . . 0.0 110.362 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -118.93 -41.55 2.76 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.469 1.105 . . . . 0.0 109.567 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 558' ' ' GLU . . . 105.48 93.5 2.31 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.508 1.13 . . . . 0.0 111.028 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.631 HD23 ' C ' ' A' ' 557' ' ' ARG . 0.2 OUTLIER -55.83 -174.5 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 0.767 . . . . 0.0 109.265 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.37 145.85 55.64 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.061 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.754 ' O ' HD13 ' A' ' 569' ' ' LEU . 0.8 OUTLIER -52.94 -38.73 62.28 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.504 1.128 . . . . 0.0 109.265 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.51 -42.49 78.46 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.462 1.101 . . . . 0.0 110.312 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . 0.508 ' CB ' HD12 ' A' ' 563' ' ' LEU . 46.9 mm-40 -67.67 -41.16 84.15 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.557 1.161 . . . . 0.0 110.228 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.485 ' CG ' ' OE2' ' A' ' 558' ' ' GLU . 0.7 OUTLIER -60.56 -36.49 78.61 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.518 1.136 . . . . 0.0 110.217 -179.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 565' ' ' ASN . 7.6 mp -71.58 -37.62 70.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.493 1.12 . . . . 0.0 109.3 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -51.58 -37.65 50.76 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 110.367 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 555' ' ' ILE . 2.7 mt -60.21 -51.01 71.38 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.435 1.085 . . . . 0.0 109.29 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.603 ' CD2' ' N ' ' A' ' 573' ' ' THR . 0.0 OUTLIER -51.44 -57.55 8.68 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.503 1.127 . . . . 0.0 108.052 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.603 ' N ' ' CD2' ' A' ' 572' ' ' TRP . 1.4 m -55.12 -32.78 62.33 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.569 1.168 . . . . 0.0 110.421 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . 0.409 HD11 HD22 ' A' ' 547' ' ' LEU . 1.5 tp -70.95 -41.41 71.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.359 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -59.6 -33.52 71.58 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 0.0 109.235 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -22.5 65.76 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.0 110.334 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.27 -27.63 24.28 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.586 1.179 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.9 mt . . . . . 0 C--N 1.327 -0.408 0 O-C-N 124.488 1.118 . . . . 0.0 109.341 179.911 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.468 0.436 0 CA-C-O 121.441 0.639 . . . . 0.0 110.08 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.76 -46.28 0.87 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.024 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.492 HD12 HG23 ' A' ' 525' ' ' ILE . 18.7 mm -57.18 -52.4 56.86 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 124.305 1.042 . . . . 0.0 108.247 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.0 mt -51.74 -42.61 62.45 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-O 117.835 -1.079 . . . . 0.0 111.413 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.566 HD13 HD23 ' A' ' 484' ' ' LEU . 92.9 mt -65.43 -62.68 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 CA-C-N 119.614 1.097 . . . . 0.0 109.945 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -57.12 -40.59 91.76 Favored Glycine 0 C--N 1.337 0.587 0 CA-C-N 120.073 1.306 . . . . 0.0 113.58 -173.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.704 HD21 HG21 ' A' ' 525' ' ' ILE . 26.2 mt -67.42 -45.53 75.84 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -63.0 -33.83 76.25 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 119.153 0.888 . . . . 0.0 110.458 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.527 HG13 HD23 ' A' ' 503' ' ' LEU . 25.5 t -62.89 -51.52 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.489 -0.757 . . . . 0.0 109.394 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.41 -14.92 60.92 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.743 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -144.81 77.42 13.42 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 126.961 2.104 . . . . 0.0 109.165 -174.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.6 -13.75 35.54 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.256 1.971 . . . . 0.0 111.688 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.64 -23.07 63.43 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.701 1.601 . . . . 0.0 110.224 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 467' ' ' LEU . 56.1 mt -58.77 -18.13 29.2 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.79 1.177 . . . . 0.0 111.022 173.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 489' ' ' VAL . . . -63.3 -19.63 64.77 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.268 -0.895 . . . . 0.0 111.989 173.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 24.0 m -83.67 -18.71 37.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.879 0.872 . . . . 0.0 110.929 174.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 464' ' ' LEU . 81.9 mt -95.32 -19.15 20.2 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.673 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 489' ' ' VAL . 0.8 OUTLIER -72.01 150.27 92.53 Favored Pre-proline 0 CA--C 1.552 1.055 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 177.332 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.2 Cg_endo -74.69 172.92 15.28 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.958 3.106 . . . . 0.0 112.021 174.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.32 13.2 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 123.117 2.545 . . . . 0.0 114.339 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.642 HD13 HD12 ' A' ' 474' ' ' LEU . 2.6 mm? 61.79 60.59 1.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.262 2.225 . . . . 0.0 112.39 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.55 -68.88 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.353 1.061 . . . . 0.0 109.911 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -71.13 -0.55 9.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.642 HD12 HD13 ' A' ' 471' ' ' LEU . 17.7 mt -100.99 -81.72 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.23 1.012 . . . . 0.0 110.473 -175.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.1 t0 62.95 153.28 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.126 1.77 . . . . 0.0 112.37 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -75.49 -22.89 56.81 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.696 -1.253 . . . . 0.0 109.484 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -52.15 -46.57 65.48 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 125.483 1.513 . . . . 0.0 110.674 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -83.07 -29.9 28.43 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 47.0 mt -128.1 98.5 26.78 Favored Pre-proline 0 C--O 1.232 0.167 0 CA-C-N 119.698 1.136 . . . . 0.0 109.738 -173.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.46 -22.67 38.62 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.262 1.975 . . . . 0.0 112.328 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -89.62 -13.95 60.5 Favored Glycine 0 CA--C 1.525 0.716 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.291 174.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.74 -25.56 63.89 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.972 1.386 . . . . 0.0 110.233 175.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.67 -47.01 13.18 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.382 0.992 . . . . 0.0 111.944 173.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 0.566 HD23 HD13 ' A' ' 455' ' ' ILE . 39.8 tp -60.36 -49.56 77.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 117.734 0.767 . . . . 0.0 110.921 174.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -57.66 -51.28 70.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.567 1.076 . . . . 0.0 111.457 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -54.17 -52.77 60.11 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.044 0.937 . . . . 0.0 109.655 176.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -61.87 -43.75 98.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.755 0.707 . . . . 0.0 110.356 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.44 HD11 HD21 ' A' ' 516' ' ' LEU . 2.3 mp -54.99 -56.49 19.1 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.89 175.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 468' ' ' VAL . 75.6 t -57.25 -47.55 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.601 0.637 . . . . 0.0 109.78 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.09 -40.94 77.92 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.477 1.035 . . . . 0.0 109.856 -176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 13.2 m -69.27 -39.77 78.18 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.226 1.411 . . . . 0.0 111.204 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.561 ' HA ' HD22 ' A' ' 498' ' ' LEU . 99.5 m -62.17 -40.71 96.94 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.047 1.294 . . . . 0.0 110.472 176.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.03 -24.55 66.02 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 125.313 1.445 . . . . 0.0 111.113 175.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 7.1 t -79.8 -53.41 6.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.808 0.843 . . . . 0.0 110.599 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -68.9 104.64 0.77 Allowed Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 125.516 1.526 . . . . 0.0 110.018 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.23 125.68 12.17 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.261 1.974 . . . . 0.0 109.582 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 64.34 36.15 92.85 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.561 HD22 ' HA ' ' A' ' 492' ' ' CYS . 20.3 tp -57.1 156.21 7.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.653 0.739 . . . . 0.0 109.647 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 3.4 p -142.66 168.17 20.35 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.336 1.454 . . . . 0.0 108.193 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -52.3 -46.23 65.85 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.049 0.94 . . . . 0.0 110.738 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -76.69 -43.96 16.99 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -62.32 -27.82 69.31 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.4 1.08 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.527 HD23 HG13 ' A' ' 459' ' ' VAL . 61.4 tp -59.03 -57.0 15.04 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 124.192 0.997 . . . . 0.0 108.506 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.659 HD21 ' HA ' ' A' ' 517' ' ' GLU . 11.2 mp -62.44 -31.54 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.535 177.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -63.37 -44.69 94.07 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.35 0.977 . . . . 0.0 110.657 176.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -63.88 -15.13 58.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.53 1.132 . . . . 0.0 111.887 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -116.23 21.61 13.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.982 1.313 . . . . 0.0 110.129 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -57.26 123.0 13.82 Favored 'General case' 0 C--O 1.227 -0.111 0 O-C-N 120.153 -1.592 . . . . 0.0 110.6 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 72.83 31.71 62.0 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.5 -0.611 . . . . 0.0 113.592 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.839 HG22 ' H ' ' A' ' 512' ' ' ASN . 38.7 m -101.6 148.54 25.1 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.643 1.577 . . . . 0.0 110.073 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.24 -15.71 27.15 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.613 -0.679 . . . . 0.0 112.754 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.839 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 m-20 -101.83 -21.46 14.58 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -177.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -44.86 -48.19 11.11 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 119.959 1.254 . . . . 0.0 110.101 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.82 81.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.766 1.167 . . . . 0.0 111.972 -177.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 54.1 m -63.21 -53.06 59.04 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 174.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.44 HD21 HD11 ' A' ' 488' ' ' LEU . 54.2 mt -55.14 -39.71 69.76 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 124.525 1.13 . . . . 0.0 110.552 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.659 ' HA ' HD21 ' A' ' 504' ' ' LEU . 9.9 tt0 -68.87 -46.12 69.26 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 127.671 2.388 . . . . 0.0 110.234 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -56.8 -42.92 80.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.517 HD13 HG22 ' A' ' 455' ' ' ILE . 90.5 mt -78.4 -14.37 59.42 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.378 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.1 t -73.03 -28.48 62.37 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.41 1.084 . . . . 0.0 110.432 174.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -2.15 21.31 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.095 1.358 . . . . 0.0 112.61 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.563 ' CE3' HD11 ' A' ' 525' ' ' ILE . 24.3 t90 -70.96 83.55 0.67 Allowed 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.8 0.84 . . . . 0.0 109.621 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -1.39 58.01 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.311 2.245 . . . . 0.0 111.312 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.18 51.23 0.67 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.481 2.313 . . . . 0.0 109.878 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.704 HG21 HD21 ' A' ' 457' ' ' LEU . 55.0 mt -135.85 -71.37 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.408 2.283 . . . . 0.0 107.542 -173.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -170.67 -89.87 0.01 OUTLIER 'General case' 0 C--N 1.351 0.633 0 C-N-CA 125.968 1.707 . . . . 0.0 110.755 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -164.8 164.54 21.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.897 3.279 . . . . 0.0 107.717 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 10.6 ttmm -62.27 -26.88 68.64 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.306 1.442 . . . . 0.0 110.331 173.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -78.41 -60.57 2.32 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 119.774 1.17 . . . . 0.0 110.386 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.87 -20.9 20.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.528 1.131 . . . . 0.0 110.638 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.503 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -50.44 -43.16 54.94 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.233 174.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -58.34 -48.32 80.93 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.502 1.501 . . . . 0.0 110.098 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -47.16 77.79 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.183 -0.948 . . . . 0.0 110.671 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 87.4 m -63.94 -26.44 68.59 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.159 1.384 . . . . 0.0 111.717 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.486 ' CD1' HD13 ' A' ' 464' ' ' LEU . 88.9 t80 -72.21 -52.98 14.0 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 119.855 1.207 . . . . 0.0 108.68 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 23.1 m -61.86 -40.44 95.34 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 123.788 0.68 . . . . 0.0 110.285 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.02 -43.9 98.21 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.725 1.148 . . . . 0.0 110.847 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.0 t -64.6 -48.32 75.38 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 124.977 1.311 . . . . 0.0 111.895 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.19 -52.03 64.66 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-O 118.019 -0.991 . . . . 0.0 108.535 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -57.46 -41.02 79.76 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 123.933 0.893 . . . . 0.0 111.328 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -63.18 -38.99 93.33 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.144 0.429 . . . . 0.0 110.728 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.11 -51.28 59.42 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 121.595 -0.691 . . . . 0.0 109.704 176.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CE1' HD11 ' A' ' 474' ' ' LEU . 12.4 m-85 -57.77 -46.94 83.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.586 0.754 . . . . 0.0 110.745 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -54.99 -50.88 67.88 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.868 2.067 . . . . 0.0 110.025 173.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 12.3 t -53.66 -47.83 70.02 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 123.389 0.676 . . . . 0.0 109.878 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.444 ' CD1' HD23 ' A' ' 474' ' ' LEU . 60.7 mt -67.16 -42.34 84.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 119.292 0.951 . . . . 0.0 110.638 -175.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.49 -38.14 88.88 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.976 0.911 . . . . 0.0 110.158 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -52.22 37.65 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 126.03 1.732 . . . . 0.0 110.003 178.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 31.7 mt -52.49 -50.57 62.5 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 125.259 1.423 . . . . 0.0 107.932 173.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -40.21 94.66 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 120.691 -1.255 . . . . 0.0 111.449 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.01 -48.63 80.93 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.441 1.019 . . . . 0.0 108.329 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -42.08 95.44 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.331 -176.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -42.06 94.09 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.005 1.722 . . . . 0.0 110.282 -178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -73.03 -30.85 64.05 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.367 177.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.489 HD11 HD13 ' A' ' 571' ' ' LEU . 12.1 mm -76.18 -31.98 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 120.127 1.33 . . . . 0.0 110.341 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.89 -29.99 70.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.469 1.507 . . . . 0.0 108.094 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -90.58 15.37 11.01 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.328 1.451 . . . . 0.0 109.417 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -97.82 -50.58 4.38 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 122.186 2.267 . . . . 0.0 109.674 174.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -0.24 12.87 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.033 1.333 . . . . 0.0 113.537 -174.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.747 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.0 OUTLIER -131.89 -81.44 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 127.819 2.447 . . . . 0.0 108.984 179.385 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.747 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -56.12 -77.18 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.549 2.34 . . . . 0.0 106.605 -174.14 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 136.42 124.58 2.37 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.346 1.451 . . . . 0.0 110.027 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.466 HD22 ' HB3' ' A' ' 567' ' ' GLU . 10.4 mt -75.83 176.92 7.35 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.18 175.15 5.56 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.383 173.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.72 -42.31 97.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.47 -51.0 11.47 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.913 0.758 . . . . 0.0 108.977 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . 0.466 ' HB3' HD22 ' A' ' 563' ' ' LEU . 2.9 mp0 -59.16 -31.23 68.79 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 120.601 -1.312 . . . . 0.0 112.624 177.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.48 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -70.81 -33.28 70.55 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.997 -1.065 . . . . 0.0 109.735 174.785 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.57 -37.83 80.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 117.74 -1.124 . . . . 0.0 109.251 176.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.45 -41.52 14.02 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.983 1.265 . . . . 0.0 109.931 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 554' ' ' LEU . 3.0 mt -62.42 -40.81 97.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.737 -1.227 . . . . 0.0 113.585 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -45.54 91.32 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.82 -30.55 70.76 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 123.773 0.67 . . . . 0.0 110.305 -177.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.7 -36.24 62.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.39 1.476 . . . . 0.0 111.312 174.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -66.15 -34.79 78.84 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.165 -1.584 . . . . 0.0 110.435 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -30.85 63.79 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.459 176.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -67.13 -41.92 85.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.662 1.585 . . . . 0.0 111.045 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 28.7 mt . . . . . 0 N--CA 1.475 0.783 0 CA-C-N 119.301 0.955 . . . . 0.0 111.884 177.926 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 N--CA 1.478 0.953 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -63.66 -32.73 74.3 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 116.065 -1.922 . . . . 0.0 110.001 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.98 -53.14 46.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 CA-C-N 119.965 1.257 . . . . 0.0 108.749 174.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -44.5 70.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.029 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.417 HG22 HD13 ' A' ' 519' ' ' LEU . 93.1 mt -69.98 -53.77 22.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.41 -36.21 83.62 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.462 1.029 . . . . 0.0 113.313 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.42 HD21 HG21 ' A' ' 525' ' ' ILE . 53.3 mt -70.07 -39.08 75.84 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 117.575 0.687 . . . . 0.0 109.657 174.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.22 -37.68 86.32 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.699 0.681 . . . . 0.0 109.967 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . 0.419 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 4.1 t -59.18 -51.84 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.474 1.11 . . . . 0.0 109.118 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -75.29 -20.19 59.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.106 0.562 . . . . 0.0 111.248 -176.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -141.94 80.31 15.62 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 126.436 1.894 . . . . 0.0 110.094 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.62 -23.73 74.8 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.779 1.653 . . . . 0.0 113.612 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -64.36 -12.78 45.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.33 0.968 . . . . 0.0 112.921 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.507 HD22 ' CD2' ' A' ' 535' ' ' PHE . 34.2 mt -64.08 -16.23 61.29 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.673 -1.267 . . . . 0.0 109.564 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.46 -28.38 69.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.834 0.854 . . . . 0.0 110.873 173.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.9 m -83.86 -14.57 50.87 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.029 0.832 . . . . 0.0 112.15 173.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -92.75 -8.71 43.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 119.389 0.995 . . . . 0.0 111.755 176.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 489' ' ' VAL . 6.0 p -81.03 149.01 65.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 CA-C-N 120.406 1.457 . . . . 0.0 109.333 178.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.48 170.13 20.09 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.501 2.801 . . . . 0.0 111.446 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -72.6 10.83 0.92 Allowed 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.686 2.924 . . . . 0.0 114.073 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.527 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.8 mp 74.73 26.45 1.39 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 128.236 2.615 . . . . 0.0 115.088 173.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -55.57 -16.5 4.04 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -175.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.07 16.46 8.48 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.72 1.208 . . . . 0.0 111.555 -178.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.608 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 4.5 mp -122.88 -56.45 1.76 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.424 1.09 . . . . 0.0 109.156 -173.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' A' ' 477' ' ' ASN . 1.3 t70 50.1 24.03 1.3 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.418 1.887 . . . . 0.0 113.106 178.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 53.67 -11.66 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 1 C-N-CA 133.52 4.728 . . . . 0.0 114.169 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 475' ' ' ASP . 25.6 t30 -88.08 -35.08 17.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 131.512 3.925 . . . . 0.0 111.164 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -75.07 -9.29 58.4 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.552 1.524 . . . . 0.0 110.759 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.616 ' HG ' HD21 ' A' ' 546' ' ' LEU . 12.6 mt -135.79 96.19 13.44 Favored Pre-proline 0 N--CA 1.452 -0.332 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -71.3 82.13 1.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.8 2.333 . . . . 0.0 110.115 -177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 143.99 -17.03 2.16 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.792 1.663 . . . . 0.0 113.353 -174.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 479' ' ' LEU . 2.2 tm? -67.89 -25.05 65.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.931 1.865 . . . . 0.0 109.928 174.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.26 -41.87 8.66 Favored Glycine 0 C--O 1.217 -0.927 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -46.31 87.46 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 118.906 1.353 . . . . 0.0 112.158 177.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -61.52 -49.93 74.73 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.56 0.744 . . . . 0.0 109.752 175.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.75 -49.97 70.89 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.183 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -56.74 -46.93 81.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.43 HD11 HD21 ' A' ' 516' ' ' LEU . 11.4 mt -56.42 -51.47 68.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.001 0.92 . . . . 0.0 111.518 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 468' ' ' VAL . 41.6 t -58.28 -44.31 87.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 119.486 1.039 . . . . 0.0 110.444 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -60.9 -45.53 94.24 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.455 1.502 . . . . 0.0 108.924 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 19.7 m -62.01 -42.77 99.52 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.496 1.518 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 81.1 m -64.96 -41.79 95.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 120.756 1.616 . . . . 0.0 110.816 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.3 -22.07 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.504 1.122 . . . . 0.0 111.978 174.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 19.8 t -88.65 -39.08 14.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.671 1.188 . . . . 0.0 111.286 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -76.19 105.51 2.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.249 1.02 . . . . 0.0 109.775 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.83 117.57 5.18 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 121.865 1.71 . . . . 0.0 110.513 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 71.05 35.12 64.6 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 177.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.449 HD21 HD13 ' A' ' 503' ' ' LEU . 21.4 tp -56.83 158.28 4.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.612 0.765 . . . . 0.0 111.17 175.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.62 168.92 18.37 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -50.48 -51.21 49.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.204 1.402 . . . . 0.0 110.686 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.79 -39.48 33.77 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -176.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -64.67 -25.45 67.95 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.307 0.643 . . . . 0.0 111.48 -177.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.449 HD13 HD21 ' A' ' 498' ' ' LEU . 57.3 tp -59.93 -52.52 65.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.562 0.745 . . . . 0.0 109.408 174.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.617 HD21 ' HA ' ' A' ' 517' ' ' GLU . 8.9 mp -62.95 -37.49 87.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.148 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.32 -39.1 85.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.11 0.564 . . . . 0.0 111.232 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -64.69 -20.52 66.36 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -114.9 16.47 17.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.444 1.497 . . . . 0.0 109.817 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -52.37 125.62 16.65 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.123 -1.61 . . . . 0.0 110.072 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 80.36 11.34 84.33 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.883 -0.954 . . . . 0.0 113.916 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.79 HG22 ' H ' ' A' ' 512' ' ' ASN . 35.2 m -93.27 147.4 22.95 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 120.133 1.966 . . . . 0.0 108.448 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.09 -15.63 46.54 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 177.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.79 ' H ' HG22 ' A' ' 510' ' ' THR . 0.1 OUTLIER -92.3 -17.85 24.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.694 1.598 . . . . 0.0 112.403 173.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.33 -38.27 68.51 Favored 'General case' 0 C--O 1.198 -1.654 0 C-N-CA 124.581 1.152 . . . . 0.0 110.466 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.14 -46.24 65.32 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 122.755 0.422 . . . . 0.0 110.618 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 97.7 m -61.58 -48.67 79.91 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.015 -1.053 . . . . 0.0 109.949 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 488' ' ' LEU . 94.9 mt -61.81 -40.66 96.02 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.678 0.791 . . . . 0.0 111.864 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.617 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.9 tt0 -62.8 -45.83 90.82 Favored 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.805 1.642 . . . . 0.0 108.532 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -63.32 -30.06 71.26 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.234 -0.889 . . . . 0.0 112.066 174.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.417 HD13 HG22 ' A' ' 455' ' ' ILE . 22.3 mt -85.37 -14.45 46.32 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.857 1.208 . . . . 0.0 113.237 176.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.8 t -75.01 -54.83 6.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.654 1.182 . . . . 0.0 108.175 177.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -74.53 13.01 0.67 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.068 2.147 . . . . 0.0 113.589 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -82.81 97.28 8.54 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.824 1.25 . . . . 0.0 113.265 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.0 14.11 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 129.134 2.973 . . . . 0.0 112.526 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -61.13 -25.07 66.73 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.425 1.89 . . . . 0.0 111.375 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.42 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -110.73 -48.55 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 127.683 2.393 . . . . 0.0 111.358 176.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.411 ' H ' HG12 ' A' ' 525' ' ' ILE . . . 52.31 20.51 1.41 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.119 2.568 . . . . 0.0 115.629 177.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -137.74 172.14 13.39 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.728 -1.232 . . . . 0.0 110.492 -173.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -124.29 -16.49 6.4 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.076 1.35 . . . . 0.0 113.844 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.36 -53.36 4.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.849 2.46 . . . . 0.0 107.756 175.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.34 -25.91 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.383 175.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.92 -59.52 4.05 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.962 1.305 . . . . 0.0 111.185 174.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.6 -44.08 80.77 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.05 0.841 . . . . 0.0 111.04 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -51.67 64.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.643 0.777 . . . . 0.0 109.793 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 53.1 m -66.36 -30.49 70.9 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.151 1.38 . . . . 0.0 110.825 -176.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.507 ' CD2' HD22 ' A' ' 464' ' ' LEU . 81.2 t80 -64.54 -56.18 15.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 176.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 98.2 m -59.46 -38.03 79.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.666 0.786 . . . . 0.0 111.258 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.11 -47.55 79.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.495 1.141 . . . . 0.0 111.237 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 24.5 t -65.62 -43.35 89.8 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 120.788 -1.195 . . . . 0.0 111.581 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.8 -50.28 63.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 118.989 0.813 . . . . 0.0 109.906 174.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -57.27 -43.97 83.55 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 123.346 0.658 . . . . 0.0 109.794 175.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.73 -40.61 88.44 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 119.312 0.96 . . . . 0.0 111.873 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.72 -51.89 67.69 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.608 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.0 m-85 -64.73 -41.97 95.56 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.867 0.867 . . . . 0.0 111.316 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.6 -49.73 74.04 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.344 2.258 . . . . 0.0 109.136 174.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 17.4 t -56.78 -43.79 81.21 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 123.471 0.708 . . . . 0.0 110.591 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.616 HD21 ' HG ' ' A' ' 479' ' ' LEU . 27.8 mt -68.45 -37.25 80.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.768 1.167 . . . . 0.0 110.358 -177.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 72.0 mt -70.27 -41.6 73.23 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.673 -0.68 . . . . 0.0 109.901 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.36 -50.82 68.43 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.347 1.459 . . . . 0.0 109.546 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.47 -47.14 73.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.072 0.949 . . . . 0.0 109.308 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -57.95 -44.84 87.22 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.303 0.956 . . . . 0.0 110.909 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -52.82 36.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.251 1.02 . . . . 0.0 109.87 173.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.08 -43.18 96.19 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.848 0.749 . . . . 0.0 110.53 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . 0.402 ' CG ' HH22 ' A' ' 557' ' ' ARG . 1.5 tp10 -59.98 -39.13 84.65 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.802 1.241 . . . . 0.0 110.096 -175.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.63 -53.28 56.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.561 1.544 . . . . 0.0 109.379 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 42.8 mm -60.58 -36.33 69.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-N 119.393 0.997 . . . . 0.0 110.93 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.0 -21.5 66.52 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.217 -1.552 . . . . 0.0 111.724 176.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . 0.402 HH22 ' CG ' ' A' ' 553' ' ' GLU . 4.2 ttm105 -84.57 -10.67 57.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 115.632 -2.128 . . . . 0.0 111.377 173.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -64.36 0.95 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 121.093 1.769 . . . . 0.0 110.257 174.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -71.56 3.23 4.11 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.816 1.247 . . . . 0.0 114.144 -173.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 46.8 p -118.72 -51.11 2.38 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.612 1.165 . . . . 0.0 111.343 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -50.56 2.83 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.734 1.214 . . . . 0.0 111.163 -174.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 123.5 131.91 3.86 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 126.29 1.9 . . . . 0.0 109.712 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.8 mt -86.56 137.85 32.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 6.3 t -68.86 167.3 15.9 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.224 1.012 . . . . 0.0 110.408 173.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -42.75 84.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.508 175.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -48.77 58.36 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 124.591 1.156 . . . . 0.0 109.823 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -60.7 -38.82 86.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.409 0.684 . . . . 0.0 110.858 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -62.48 -35.6 79.84 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.38 -0.825 . . . . 0.0 109.629 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 6.2 mp -71.96 -43.15 65.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 117.14 -1.41 . . . . 0.0 110.881 173.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -51.99 -37.49 53.36 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.469 1.031 . . . . 0.0 109.522 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.8 mt -62.9 -42.12 99.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 116.608 -1.663 . . . . 0.0 113.483 174.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -58.39 -44.96 89.17 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 121.37 1.896 . . . . 0.0 108.482 175.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -48.61 76.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -175.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.2 -42.11 98.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.74 1.216 . . . . 0.0 111.373 177.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -57.35 -45.36 84.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.365 0.666 . . . . 0.0 109.333 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -73.25 -27.45 61.59 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.135 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.09 -36.86 80.48 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.667 1.587 . . . . 0.0 109.564 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.4 mt . . . . . 0 N--CA 1.468 0.437 0 C-N-CA 123.799 0.84 . . . . 0.0 111.805 177.618 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.9 ptt? . . . . . 0 C--O 1.224 -0.243 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.96 -21.98 65.95 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 116.907 -1.52 . . . . 0.0 111.046 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.523 HD13 HG21 ' A' ' 525' ' ' ILE . 0.5 OUTLIER -53.1 -48.74 52.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 C-N-CA 126.181 1.792 . . . . 0.0 109.453 173.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 32.6 mt -53.5 -45.08 69.53 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 118.657 0.662 . . . . 0.0 109.906 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.559 HG23 HD13 ' A' ' 488' ' ' LEU . 95.7 mt -72.18 -51.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.341 176.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -65.04 -32.43 84.13 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-N 121.431 1.923 . . . . 0.0 113.373 -173.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.422 ' CD1' HG23 ' A' ' 453' ' ' ILE . 71.4 mt -70.39 -40.22 74.07 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.17 174.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -34.44 77.82 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.932 1.293 . . . . 0.0 109.99 174.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 16.4 t -60.65 -58.65 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 500' ' ' THR . 32.8 mt-30 -71.77 -22.32 61.61 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.19 -177.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.462 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.1 OUTLIER -135.44 77.53 53.13 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 127.051 2.141 . . . . 0.0 108.455 -176.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.08 -13.67 36.81 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 121.311 1.341 . . . . 0.0 112.485 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -70.49 -19.79 62.9 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.725 0.81 . . . . 0.0 111.323 173.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.462 HD12 ' HB3' ' A' ' 461' ' ' ASN . 36.0 mt -62.96 -15.66 56.69 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.399 1.454 . . . . 0.0 110.571 175.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.505 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -64.65 -30.97 72.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 119.36 0.982 . . . . 0.0 110.832 174.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.1 m -74.84 -19.48 60.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.997 0.817 . . . . 0.0 110.792 174.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 25.1 mt -91.0 -22.56 20.74 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 120.865 -1.147 . . . . 0.0 110.798 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -70.06 156.34 91.96 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 118.947 0.794 . . . . 0.0 110.244 179.299 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.673 ' HD2' HG22 ' A' ' 468' ' ' VAL . 23.0 Cg_endo -74.74 174.01 13.42 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 124.475 3.45 . . . . 0.0 112.448 176.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -76.71 12.04 1.77 Allowed 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 121.698 1.599 . . . . 0.0 113.519 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.564 HD22 ' HG3' ' A' ' 486' ' ' ARG . 10.2 mp 64.54 46.86 3.11 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.766 2.426 . . . . 0.0 112.428 176.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.03 -42.12 60.78 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -105.68 17.76 23.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.765 1.226 . . . . 0.0 111.053 -175.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.618 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.5 mm? -97.64 -77.56 0.5 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -173.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 31.3 t0 64.41 141.42 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.258 2.223 . . . . 0.0 112.781 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -68.44 -20.06 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 120.997 -1.065 . . . . 0.0 109.547 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -62.31 -45.61 92.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.93 1.292 . . . . 0.0 110.285 173.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -80.62 -35.74 33.6 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 121.661 -0.649 . . . . 0.0 110.124 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 546' ' ' LEU . 2.4 mm? -121.37 103.58 41.45 Favored Pre-proline 0 CA--C 1.534 0.344 0 C-N-CA 124.032 0.933 . . . . 0.0 108.876 -176.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.11 -20.45 33.19 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.544 1.496 . . . . 0.0 112.356 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.9 -8.9 61.47 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.703 -1.054 . . . . 0.0 112.742 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -32.33 71.05 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 116.256 -1.831 . . . . 0.0 109.721 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.46 -48.73 16.36 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.572 1.533 . . . . 0.0 111.238 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.68 -44.89 95.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.836 -0.803 . . . . 0.0 111.692 175.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 57.4 t80 -64.37 -48.79 74.15 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 119.115 0.871 . . . . 0.0 111.718 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.564 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.3 OUTLIER -54.23 -53.63 51.0 Favored 'General case' 0 CA--C 1.504 -0.811 0 C-N-CA 125.272 1.429 . . . . 0.0 108.186 175.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.07 -41.58 92.72 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.629 1.104 . . . . 0.0 110.872 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.559 HD13 HG23 ' A' ' 455' ' ' ILE . 3.4 mt -56.42 -56.86 15.88 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.136 0.974 . . . . 0.0 110.158 173.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 468' ' ' VAL . 53.5 t -58.7 -46.34 90.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.428 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -55.97 -46.45 78.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 125.779 1.632 . . . . 0.0 108.755 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 24.0 m -62.15 -44.13 97.3 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 125.81 1.644 . . . . 0.0 111.072 174.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.19 -37.12 86.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.069 0.849 . . . . 0.0 110.594 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -28.42 70.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.003 1.321 . . . . 0.0 109.679 174.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.67 -57.09 4.0 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.26 -0.9 . . . . 0.0 110.329 174.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -61.03 108.59 1.55 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.604 1.162 . . . . 0.0 110.241 -175.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -73.81 141.02 29.83 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 122.238 1.959 . . . . 0.0 109.398 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 50.24 33.58 23.59 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.097 1.332 . . . . 0.0 111.873 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 36.8 tp -54.03 156.3 3.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.976 1.37 . . . . 0.0 109.651 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . 0.404 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.2 p -135.05 163.77 29.13 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.537 HG23 ' HA ' ' A' ' 460' ' ' GLN . 8.3 m -50.84 -46.97 60.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 125.593 1.557 . . . . 0.0 110.468 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.93 -41.6 27.38 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.404 ' HB3' ' H ' ' A' ' 499' ' ' THR . 28.1 tp60 -62.33 -24.67 67.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.609 -0.936 . . . . 0.0 110.459 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 40.9 tp -68.37 -45.36 72.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 119.606 1.094 . . . . 0.0 108.902 174.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.66 -38.62 85.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.608 -0.711 . . . . 0.0 111.012 175.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.26 -39.35 82.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.126 0.571 . . . . 0.0 111.355 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -66.98 -20.46 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 120.539 -1.35 . . . . 0.0 112.144 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -111.35 15.05 21.55 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.476 1.11 . . . . 0.0 109.931 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -54.63 128.59 33.09 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 119.985 -1.697 . . . . 0.0 110.173 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 76.7 15.42 81.6 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.272 -0.738 . . . . 0.0 114.108 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.83 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.7 m -93.98 145.95 24.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.885 1.343 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -59.41 -22.87 62.06 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.025 -1.047 . . . . 0.0 111.427 174.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.83 ' H ' HG22 ' A' ' 510' ' ' THR . 0.9 OUTLIER -92.63 -13.95 28.83 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 123.786 0.835 . . . . 0.0 112.533 178.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.29 -43.23 74.58 Favored 'General case' 0 C--O 1.209 -1.028 0 O-C-N 123.558 0.536 . . . . 0.0 109.735 173.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.46 -43.51 75.56 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 112.624 177.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 87.3 m -63.24 -50.06 71.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.376 -0.827 . . . . 0.0 109.141 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.516 HD21 HD11 ' A' ' 488' ' ' LEU . 48.7 mt -58.74 -42.15 88.11 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.565 0.746 . . . . 0.0 112.399 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.74 -42.74 81.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.304 1.842 . . . . 0.0 108.608 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -59.15 -30.68 68.33 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.515 -0.755 . . . . 0.0 111.01 173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 56.3 mt -89.29 -3.86 58.35 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.19 0.905 . . . . 0.0 111.913 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.0 t -79.1 -50.48 10.97 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.117 1.367 . . . . 0.0 109.396 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.57 9.77 8.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' A' ' 525' ' ' ILE . 3.2 t90 -59.97 112.67 1.96 Allowed 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 125.556 1.542 . . . . 0.0 115.01 -173.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.96 -29.22 49.69 Favored 'General case' 0 C--N 1.326 -0.432 1 C-N-CA 131.76 4.024 . . . . 0.0 114.389 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -53.81 -27.31 28.57 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.224 1.81 . . . . 0.0 112.786 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.523 HG21 HD13 ' A' ' 453' ' ' ILE . 1.2 pt -123.53 -66.88 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 C-N-CA 124.673 1.189 . . . . 0.0 110.472 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.23 42.32 13.29 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.243 1.417 . . . . 0.0 114.005 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.58 172.13 13.24 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.856 -1.152 . . . . 0.0 111.4 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.44 -27.96 3.39 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.938 2.095 . . . . 0.0 111.906 175.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -80.9 -54.48 5.55 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.413 1.085 . . . . 0.0 108.513 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.84 -15.0 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 124.721 1.208 . . . . 0.0 109.598 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.417 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -61.41 -60.95 2.93 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 119.969 1.259 . . . . 0.0 110.746 173.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -55.96 -40.72 73.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.912 0.778 . . . . 0.0 111.31 -177.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -53.1 54.52 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.194 -0.316 . . . . 0.0 111.541 177.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 86.4 m -63.78 -27.39 69.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.184 0.993 . . . . 0.0 110.758 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.462 ' CD2' HD22 ' A' ' 464' ' ' LEU . 54.6 t80 -67.72 -53.25 28.97 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 120.173 1.351 . . . . 0.0 107.684 178.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 72.9 m -66.22 -39.09 89.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.291 -0.862 . . . . 0.0 111.213 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.38 -44.33 97.35 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.612 1.097 . . . . 0.0 109.614 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 14.8 t -61.22 -55.11 35.82 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 120.954 -1.091 . . . . 0.0 110.604 176.104 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.12 -44.34 79.04 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 125.009 1.323 . . . . 0.0 108.831 -178.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.01 -44.0 98.06 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.353 0.979 . . . . 0.0 110.428 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -67.55 -40.75 84.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.891 0.769 . . . . 0.0 111.539 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.2 mmt -59.44 -53.1 62.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 121.14 -0.975 . . . . 0.0 109.504 173.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.618 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.6 m-85 -59.69 -45.09 93.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.545 0.738 . . . . 0.0 111.428 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -57.67 -46.76 83.83 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.051 1.34 . . . . 0.0 109.807 177.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.7 t -56.15 -39.12 71.8 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.484 0.714 . . . . 0.0 110.893 174.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 479' ' ' LEU . 38.2 mt -73.89 -35.04 64.65 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 120.675 -1.266 . . . . 0.0 110.819 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.8 -43.6 79.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.661 1.185 . . . . 0.0 108.737 175.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -59.49 -53.58 56.53 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.554 1.142 . . . . 0.0 110.571 174.103 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 56.5 mt -57.41 -43.21 83.56 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.815 -0.553 . . . . 0.0 110.325 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -59.29 -44.06 92.52 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 117.231 -1.366 . . . . 0.0 109.464 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.38 -50.74 66.8 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 119.329 0.968 . . . . 0.0 110.209 176.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -44.92 89.14 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.675 -0.678 . . . . 0.0 110.039 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -41.42 96.19 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.159 0.984 . . . . 0.0 109.769 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 10.7 mt -60.85 -52.46 64.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.602 1.561 . . . . 0.0 108.909 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.419 HD13 HD13 ' A' ' 571' ' ' LEU . 47.3 mm -61.62 -36.27 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-N 119.967 1.258 . . . . 0.0 111.162 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.47 -24.88 66.88 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.277 -1.514 . . . . 0.0 110.745 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -84.65 -7.03 59.38 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 115.808 -2.044 . . . . 0.0 111.659 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.13 -60.33 2.56 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 122.54 2.427 . . . . 0.0 106.525 173.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -76.08 -4.4 41.23 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.301 -1.499 . . . . 0.0 113.99 -173.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -114.88 -63.67 1.42 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 121.171 1.805 . . . . 0.0 109.884 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -74.89 -44.51 48.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.538 1.135 . . . . 0.0 111.499 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 111.99 3.98 26.17 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 116.339 -2.367 . . . . 0.0 113.65 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 4.1 mt 41.17 -159.05 0.01 OUTLIER 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 127.866 2.467 . . . . 0.0 110.915 -173.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 29.6 t -139.33 160.23 40.32 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -40.17 74.07 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.3 -52.09 13.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.884 0.874 . . . . 0.0 109.603 -178.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.96 -36.54 75.0 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.297 0.953 . . . . 0.0 111.325 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 17.8 ttt85 -61.83 -32.58 72.91 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.128 -1.608 . . . . 0.0 111.138 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 85.9 mt -80.71 -33.44 35.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.954 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -53.36 -46.1 69.44 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 555' ' ' ILE . 5.5 mt -56.45 -40.5 74.92 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 116.868 -1.539 . . . . 0.0 113.605 174.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.33 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 122.405 2.366 . . . . 0.0 109.071 175.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 2.8 m -62.31 -47.61 83.5 Favored 'General case' 0 CA--C 1.528 0.112 0 O-C-N 125.114 1.509 . . . . 0.0 107.215 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.28 87.24 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.712 -1.242 . . . . 0.0 111.001 177.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -65.08 -37.14 86.55 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.041 -1.037 . . . . 0.0 111.184 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -75.53 -25.38 57.14 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.679 -1.153 . . . . 0.0 110.364 175.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -45.58 77.6 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.416 1.007 . . . . 0.0 108.339 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 4.9 mt . . . . . 0 N--CA 1.471 0.584 0 C-N-CA 124.782 1.233 . . . . 0.0 112.844 179.294 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 121.193 0.521 . . . . 0.0 110.841 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 71.2 mtt-85 -56.76 -27.64 59.81 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 115.513 -2.184 . . . . 0.0 109.978 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.8 mm -64.77 -53.22 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 119.858 1.208 . . . . 0.0 108.861 174.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.458 HD23 ' CE1' ' A' ' 535' ' ' PHE . 11.6 mt -59.44 -46.8 87.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.394 0.997 . . . . 0.0 110.147 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.647 ' CG2' HD13 ' A' ' 519' ' ' LEU . 15.7 mt -68.29 -57.87 7.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.999 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.973 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . 0.508 ' HA3' ' CE3' ' A' ' 522' ' ' TRP . . . -52.62 -42.52 58.4 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 126.285 1.898 . . . . 0.0 111.577 -178.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.883 HD21 HG21 ' A' ' 525' ' ' ILE . 97.4 mt -68.26 -44.25 76.0 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-O 117.693 -1.146 . . . . 0.0 109.686 173.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 458' ' ' LEU . 3.4 tm? -59.78 -30.78 69.12 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.626 1.103 . . . . 0.0 110.893 175.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.11 -49.94 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -74.96 -18.89 60.31 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.484 0.659 . . . . 0.0 111.922 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.751 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.6 t-20 -137.56 83.82 24.43 Favored Pre-proline 0 N--CA 1.44 -0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 107.862 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 23.8 Cg_endo -68.51 -19.86 42.15 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.596 1.531 . . . . 0.0 111.852 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.03 -28.54 70.16 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.214 173.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.817 HD22 ' CD2' ' A' ' 535' ' ' PHE . 15.8 mt -59.87 -16.98 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.609 -1.307 . . . . 0.0 111.766 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.711 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -60.08 -27.47 67.01 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.85 -0.531 . . . . 0.0 111.221 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 -16.51 49.56 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 120.139 -1.601 . . . . 0.0 112.847 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . 0.58 HD12 HD23 ' A' ' 464' ' ' LEU . 8.3 mt -85.16 -18.57 33.73 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.777 1.231 . . . . 0.0 108.827 175.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -66.87 148.63 98.78 Favored Pre-proline 0 N--CA 1.439 -0.99 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.782 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.668 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.6 Cg_endo -73.95 179.43 5.72 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 122.099 1.866 . . . . 0.0 111.04 178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -79.72 14.45 1.85 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.826 3.018 . . . . 0.0 112.208 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.541 HD13 HD12 ' A' ' 474' ' ' LEU . 0.3 OUTLIER 69.09 70.35 0.27 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 126.375 1.87 . . . . 0.0 107.693 174.412 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -105.39 -57.79 1.99 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.062 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -80.79 11.93 3.56 Favored 'General case' 0 CA--C 1.498 -1.046 0 C-N-CA 123.565 0.746 . . . . 0.0 112.491 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.841 HD13 HD21 ' A' ' 482' ' ' LEU . 36.8 mt -119.59 -49.99 2.33 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.915 0.886 . . . . 0.0 111.389 -173.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.4 t70 46.39 25.45 0.38 Allowed 'General case' 0 C--N 1.363 1.184 0 C-N-CA 128.6 2.76 . . . . 0.0 111.165 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 40.9 26.39 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 129.378 3.071 . . . . 0.0 112.874 -175.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -135.1 15.6 3.51 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 131.377 3.871 . . . . 0.0 111.607 -177.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.521 ' HB3' HD22 ' A' ' 546' ' ' LEU . 5.4 mmpt? -97.49 -42.76 7.56 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.591 174.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 482' ' ' LEU . 2.1 mm? -121.98 145.47 43.78 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -72.5 5.67 2.7 Favored 'Trans proline' 0 N--CA 1.477 0.544 0 C-N-CA 123.314 2.676 . . . . 0.0 114.258 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -125.32 -11.28 4.25 Favored Glycine 0 N--CA 1.44 -1.074 0 CA-C-O 116.752 -2.138 . . . . 0.0 109.593 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 479' ' ' LEU . 0.3 OUTLIER -53.35 -45.08 69.01 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 119.905 1.852 . . . . 0.0 107.565 -178.469 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -50.75 -49.5 40.7 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 176.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 30.2 tp -61.38 -53.19 59.81 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 118.281 1.041 . . . . 0.0 111.085 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 489' ' ' VAL . 12.6 t80 -52.41 -48.08 65.92 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 123.534 0.734 . . . . 0.0 110.865 175.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -59.67 -50.84 72.29 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.74 -44.56 96.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.818 0.847 . . . . 0.0 111.324 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.605 HD11 HD21 ' A' ' 516' ' ' LEU . 4.7 mt -59.17 -45.56 90.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.232 1.013 . . . . 0.0 109.755 177.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -65.69 -45.05 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.517 176.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -54.19 -42.85 70.18 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.379 1.071 . . . . 0.0 109.776 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.3 m -71.65 -43.26 66.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.173 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.477 ' HA ' HD22 ' A' ' 498' ' ' LEU . 57.4 m -55.85 -48.41 75.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.776 1.171 . . . . 0.0 109.583 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.1 -21.27 58.99 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 125.85 1.66 . . . . 0.0 110.745 177.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.48 5.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.075 0.95 . . . . 0.0 109.791 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -63.12 104.64 0.52 Allowed Pre-proline 0 N--CA 1.468 0.452 0 C-N-CA 125.837 1.655 . . . . 0.0 110.496 -176.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -70.5 133.21 23.71 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 121.328 1.352 . . . . 0.0 110.485 -178.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.79 37.91 52.8 Favored Glycine 0 N--CA 1.469 0.853 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 503' ' ' LEU . 43.3 tp -57.82 156.09 9.37 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.393 0.616 . . . . 0.0 109.935 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.48 168.36 19.08 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -174.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.0 m -58.18 -38.03 75.89 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.55 0.74 . . . . 0.0 110.041 173.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.18 -41.38 8.04 Favored Glycine 0 C--N 1.339 0.724 0 O-C-N 120.798 -1.189 . . . . 0.0 110.431 -177.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.496 ' HB3' HD12 ' A' ' 498' ' ' LEU . 39.3 tp60 -60.57 -27.87 68.02 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 117.679 -1.153 . . . . 0.0 109.691 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 498' ' ' LEU . 30.2 tp -64.39 -53.81 42.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 119.601 1.091 . . . . 0.0 109.646 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.3 mm? -61.28 -34.58 75.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.457 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -71.94 -35.46 69.63 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.327 0.651 . . . . 0.0 111.946 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -72.55 -5.21 35.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.089 2.156 . . . . 0.0 111.676 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.598 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 44.0 m-85 -122.83 18.29 10.21 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.864 1.666 . . . . 0.0 109.774 174.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.67 134.51 56.88 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 119.525 -1.985 . . . . 0.0 109.292 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 70.53 21.44 77.63 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.023 176.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.881 HG22 ' H ' ' A' ' 512' ' ' ASN . 95.3 m -94.43 144.78 25.27 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.341 1.571 . . . . 0.0 108.697 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -63.02 -17.27 62.03 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.469 -0.769 . . . . 0.0 109.11 173.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.881 ' H ' HG22 ' A' ' 510' ' ' THR . 42.8 m-80 -96.95 -20.59 17.99 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 119.318 -2.114 . . . . 0.0 111.246 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -45.18 -39.78 6.54 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 124.889 1.368 . . . . 0.0 109.278 178.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.48 20.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 111.201 177.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 98.4 m -57.86 -41.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.354 0 O-C-N 120.675 -1.265 . . . . 0.0 110.713 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.605 HD21 HD11 ' A' ' 488' ' ' LEU . 28.8 mt -64.96 -31.62 72.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.808 175.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.493 ' HA ' HD11 ' A' ' 504' ' ' LEU . 0.0 OUTLIER -72.94 -45.45 57.97 Favored 'General case' 0 CA--C 1.506 -0.75 0 C-N-CA 125.95 1.7 . . . . 0.0 109.284 -176.174 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -35.73 80.91 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 119.639 -0.825 . . . . 0.0 109.72 175.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.647 HD13 ' CG2' ' A' ' 455' ' ' ILE . 48.0 mt -77.69 -13.61 59.85 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 119.079 -0.486 . . . . 0.0 111.86 177.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . 0.517 ' HB2' HD21 ' A' ' 504' ' ' LEU . 10.2 t -76.48 -60.82 2.18 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 126.012 1.725 . . . . 0.0 108.215 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -2.52 14.32 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 177.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.601 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.3 t90 -49.49 115.75 1.47 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 123.456 0.703 . . . . 0.0 109.962 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.09 2.76 35.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.925 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -54.87 -23.83 20.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 118.776 0.717 . . . . 0.0 112.411 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.883 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -109.68 -53.73 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 127.469 2.308 . . . . 0.0 109.493 178.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.28 47.61 5.63 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.627 1.571 . . . . 0.0 111.159 -178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -161.11 151.05 17.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -174.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 -33.44 7.2 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.968 1.707 . . . . 0.0 113.021 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.96 -60.48 2.34 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 126.492 1.917 . . . . 0.0 109.456 177.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 87.2 mt -55.26 -29.39 23.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 117.071 -1.443 . . . . 0.0 107.173 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.439 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -46.9 -55.07 8.65 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.256 1.389 . . . . 0.0 111.514 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -56.4 -43.99 79.84 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.193 0.906 . . . . 0.0 110.23 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -48.35 79.43 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.372 177.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 40.2 m -64.14 -31.15 72.24 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.358 1.863 . . . . 0.0 108.281 -177.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.817 ' CD2' HD22 ' A' ' 464' ' ' LEU . 41.5 t80 -69.25 -59.28 3.12 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 124.853 1.261 . . . . 0.0 109.807 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -58.38 -40.16 81.57 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.493 178.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.57 -45.19 92.58 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 118.577 0.626 . . . . 0.0 112.151 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.9 t -67.48 -50.95 56.72 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 117.6 -1.191 . . . . 0.0 110.385 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -44.79 72.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.981 1.712 . . . . 0.0 108.567 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.88 -38.69 92.01 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 124.721 1.263 . . . . 0.0 110.532 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -72.42 -39.41 67.9 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 119.146 0.885 . . . . 0.0 109.051 -176.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -59.85 4.43 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 126.198 1.799 . . . . 0.0 107.462 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.643 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.3 m-85 -54.54 -46.47 73.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 125.014 1.446 . . . . 0.0 110.055 -179.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -56.97 -48.89 77.32 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.078 0.951 . . . . 0.0 109.254 178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -47.59 67.22 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.521 HD22 ' HB3' ' A' ' 478' ' ' LYS . 20.4 mt -63.8 -45.77 88.16 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.219 -0.3 . . . . 0.0 110.359 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -37.02 73.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.495 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -63.06 -50.15 71.71 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.89 1.276 . . . . 0.0 109.519 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 1.4 mt -60.77 -48.45 81.75 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . 0.446 ' O ' HD12 ' A' ' 554' ' ' LEU . 4.1 ttp180 -57.13 -52.99 63.08 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.731 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -50.19 -54.05 23.62 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.725 1.21 . . . . 0.0 108.748 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -58.3 -39.26 78.86 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-O 117.832 -1.08 . . . . 0.0 109.832 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.43 -39.1 75.48 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 120.031 1.287 . . . . 0.0 112.629 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -65.38 -51.9 57.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 176.248 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 571' ' ' LEU . 28.2 mm -65.65 -36.28 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 123.528 1.632 . . . . 0.0 113.115 -179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -59.84 -28.58 67.61 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 120.519 -1.363 . . . . 0.0 109.973 174.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.01 14.0 33.37 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 125.047 1.339 . . . . 0.0 110.983 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . 0.523 ' HG3' HD11 ' A' ' 563' ' ' LEU . 19.1 tt0 -100.64 -41.68 6.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 118.987 0.812 . . . . 0.0 109.182 176.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -79.48 -14.76 58.68 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.316 -0.865 . . . . 0.0 111.169 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 72.3 p -101.11 -88.51 0.37 Allowed 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -174.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -51.27 48.51 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 125.184 1.552 . . . . 0.0 108.312 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 89.76 79.49 1.34 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.609 1.576 . . . . 0.0 109.243 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.523 HD11 ' HG3' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -41.21 159.34 0.02 OUTLIER 'General case' 0 C--N 1.346 0.431 0 C-N-CA 127.012 2.125 . . . . 0.0 110.867 172.746 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.1 p -59.4 163.02 4.27 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 122.439 1.114 . . . . 0.0 109.776 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . 0.509 ' O ' HD23 ' A' ' 569' ' ' LEU . 0.7 OUTLIER -54.96 -42.16 72.02 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 110.742 173.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -62.59 -46.74 86.94 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.365 1.066 . . . . 0.0 110.102 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -64.26 -34.21 77.59 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.178 0.513 . . . . 0.0 111.051 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -37.96 88.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 121.165 -0.96 . . . . 0.0 110.64 176.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . 0.509 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.8 mm? -67.48 -44.34 78.77 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 117.657 -1.163 . . . . 0.0 108.905 178.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.72 -37.11 58.61 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 118.768 0.713 . . . . 0.0 110.52 179.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.1 mt -60.51 -51.54 69.0 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 115.57 -2.157 . . . . 0.0 112.154 174.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.422 ' HD1' HD13 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -45.97 -49.94 15.33 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 121.621 2.009 . . . . 0.0 109.536 174.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.95 -32.63 74.44 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.192 1.397 . . . . 0.0 110.628 -177.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . 0.555 ' CD1' HD12 ' A' ' 578' ' ' LEU . 1.7 tm? -76.43 -43.05 41.88 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.532 1.133 . . . . 0.0 109.255 174.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.46 -46.53 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 119.253 -2.155 . . . . 0.0 108.6 -176.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.99 71.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.808 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -44.08 81.17 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.093 1.757 . . . . 0.0 107.89 -175.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.555 HD12 ' CD1' ' A' ' 574' ' ' LEU . 13.0 mt . . . . . 0 CA--C 1.516 -0.354 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.545 178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 5.1 ppp? . . . . . 0 CA--C 1.542 0.663 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 5.5 mpt_? -65.76 -39.17 90.77 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.762 -1.589 . . . . 0.0 111.692 173.905 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.8 mm -61.27 -53.18 52.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.6 mt -60.07 -45.75 91.86 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.458 1.026 . . . . 0.0 111.282 -175.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.55 -54.06 29.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.74 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -60.8 -32.1 78.08 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 119.741 1.155 . . . . 0.0 112.538 -175.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.29 -47.83 63.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 117.677 0.739 . . . . 0.0 109.392 173.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -59.9 -28.05 67.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.489 0.715 . . . . 0.0 111.001 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 40.0 t -68.33 -57.23 9.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.197 0 O-C-N 121.047 -1.033 . . . . 0.0 108.959 173.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.56 -18.48 61.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.735 -0.603 . . . . 0.0 111.665 -174.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -142.53 83.41 11.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 126.483 1.913 . . . . 0.0 109.623 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -70.79 -13.63 32.24 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 121.264 1.309 . . . . 0.0 112.975 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -68.51 -14.26 62.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.755 1.161 . . . . 0.0 110.464 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 67.0 mt -63.4 -13.6 41.45 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.157 -0.965 . . . . 0.0 109.584 173.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.41 -24.31 67.59 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.121 -0.987 . . . . 0.0 110.929 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.8 m -83.64 -13.99 52.95 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.234 0.924 . . . . 0.0 110.908 173.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.7 mt -94.8 -14.22 24.88 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.333 1.053 . . . . 0.0 112.047 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 489' ' ' VAL . 9.5 p -91.21 142.83 27.55 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 120.411 1.459 . . . . 0.0 108.869 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -68.61 170.67 14.63 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.05 13.07 0.15 Allowed 'Trans proline' 0 CA--C 1.554 1.512 0 C-N-CA 124.924 3.749 . . . . 0.0 115.213 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 474' ' ' LEU . 1.5 mm? 72.08 46.01 0.36 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.668 2.787 . . . . 0.0 113.359 173.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.39 -83.32 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.714 2.005 . . . . 0.0 111.694 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.13 -2.38 12.82 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 119.882 -1.761 . . . . 0.0 113.48 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.439 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 4.1 mm? -74.8 -76.62 0.14 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.256 1.823 . . . . 0.0 108.214 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 57.1 t0 62.25 131.71 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 124.139 1.923 . . . . 0.0 113.042 -177.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.47 -20.32 65.48 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.995 1.718 . . . . 0.0 110.394 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -73.08 -33.5 65.66 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.731 1.212 . . . . 0.0 110.456 174.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -80.67 -39.35 27.42 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.418 1.463 . . . . 0.0 111.812 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.589 HD21 HD11 ' A' ' 546' ' ' LEU . 1.5 mm? -119.09 118.22 32.94 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.96 2.74 2.84 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.136 1.891 . . . . 0.0 113.576 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -114.9 0.63 22.94 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 118.064 -1.409 . . . . 0.0 111.892 174.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 0.426 ' HB2' ' HB2' ' A' ' 479' ' ' LEU . 0.3 OUTLIER -63.48 -47.91 79.84 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 119.158 1.479 . . . . 0.0 108.138 176.744 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -51.53 -49.37 46.27 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 118.765 0.711 . . . . 0.0 112.116 -176.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.43 -47.29 86.72 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.695 -0.886 . . . . 0.0 110.732 177.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -65.1 -39.55 93.31 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.249 0.62 . . . . 0.0 111.214 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -60.75 -53.22 60.05 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 126.544 1.938 . . . . 0.0 108.378 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -58.45 -40.99 84.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.857 0.723 . . . . 0.0 110.04 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 516' ' ' LEU . 0.9 OUTLIER -56.14 -57.5 11.9 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.99 0.516 . . . . 0.0 111.704 174.337 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -60.09 -43.8 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 123.859 0.864 . . . . 0.0 110.205 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -57.59 -49.47 76.3 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.321 1.848 . . . . 0.0 109.245 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 96.7 m -58.95 -42.34 89.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.861 1.264 . . . . 0.0 110.758 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.92 -45.0 87.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.524 0.602 . . . . 0.0 109.802 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.89 -23.01 67.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.912 0.885 . . . . 0.0 112.226 174.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 6.1 t -86.28 -11.63 51.73 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.247 1.819 . . . . 0.0 113.45 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -133.22 75.47 70.84 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.19 1.796 . . . . 0.0 108.6 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.69 125.27 14.03 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.643 1.562 . . . . 0.0 109.586 -178.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 93.77 9.44 59.84 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.169 -175.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 1.7 tt -62.44 155.14 26.24 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.842 1.321 . . . . 0.0 108.24 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . 0.5 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.1 p -127.21 169.8 13.09 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 123.85 0.86 . . . . 0.0 110.003 -173.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -50.01 -51.77 39.3 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.323 1.449 . . . . 0.0 109.962 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.22 -38.71 28.81 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -175.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.5 ' HB3' ' H ' ' A' ' 499' ' ' THR . 9.0 tp-100 -63.93 -25.77 68.29 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.73 -0.652 . . . . 0.0 110.728 179.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 18.7 tp -63.48 -44.4 94.53 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.417 1.008 . . . . 0.0 111.014 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 520' ' ' SER . 10.0 mp -65.57 -40.8 93.18 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -63.7 -38.3 90.58 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -70.91 -20.67 62.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.092 -1.005 . . . . 0.0 112.947 -179.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -106.72 11.94 29.73 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.464 1.106 . . . . 0.0 109.682 174.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.0 ttt180 -56.52 128.71 37.5 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 120.33 -1.481 . . . . 0.0 111.005 -174.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.23 5.93 86.81 Favored Glycine 0 CA--C 1.535 1.291 0 CA-C-O 118.495 -1.17 . . . . 0.0 113.502 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.838 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -93.93 147.18 23.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 119.59 1.695 . . . . 0.0 107.382 -174.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -59.4 -17.71 32.75 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 120.691 -1.256 . . . . 0.0 113.328 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.838 ' H ' HG22 ' A' ' 510' ' ' THR . 7.5 m-80 -92.96 -19.47 21.58 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-O 117.756 -1.116 . . . . 0.0 110.973 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -46.27 -50.09 16.54 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.64 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.88 -45.3 64.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 0.0 112.178 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 25.8 m -58.42 -49.66 76.48 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.972 -0.537 . . . . 0.0 110.669 173.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 488' ' ' LEU . 35.1 mt -67.6 -35.76 79.59 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 123.788 0.835 . . . . 0.0 111.516 -176.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.13 -47.61 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.911 2.084 . . . . 0.0 107.611 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.26 -29.88 70.11 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 117.509 -1.234 . . . . 0.0 112.213 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 81.8 mt -89.44 -10.86 44.83 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.51 1.05 . . . . 0.0 112.263 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 504' ' ' LEU . 18.3 t -77.64 -54.08 6.81 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.454 1.502 . . . . 0.0 109.819 174.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.78 19.1 1.76 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.751 1.221 . . . . 0.0 112.571 -178.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -74.95 102.23 4.72 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 116.816 2.154 . . . . 0.0 116.816 -172.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -3.74 18.65 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 129.755 3.222 . . . . 0.0 113.693 178.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.91 -20.39 52.96 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.138 -0.976 . . . . 0.0 111.379 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.12 -63.28 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 126.01 1.724 . . . . 0.0 109.701 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 46.27 25.12 0.33 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.807 2.043 . . . . 0.0 115.889 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -126.23 177.11 6.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.036 1.335 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.32 -21.66 2.29 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.32 1.448 . . . . 0.0 112.982 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -88.22 -56.95 3.11 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.751 2.02 . . . . 0.0 108.036 174.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 43.1 mt -58.51 -31.37 43.31 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -51.32 -54.17 28.76 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 118.651 0.66 . . . . 0.0 112.251 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.77 -45.98 84.07 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.312 0.505 . . . . 0.0 109.91 -177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.15 -44.74 94.74 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.108 0.563 . . . . 0.0 110.972 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 96.8 m -69.1 -30.81 69.18 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.503 176.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -62.13 -55.15 31.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 120.879 1.672 . . . . 0.0 108.698 174.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.6 m -60.36 -41.41 93.63 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.055 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.97 -47.32 78.01 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.919 0.781 . . . . 0.0 111.929 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 46.5 t -61.21 -50.01 74.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.499 1.52 . . . . 0.0 111.536 177.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.42 -49.48 72.3 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.152 1.381 . . . . 0.0 110.138 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -58.62 -46.08 87.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 118.193 -0.908 . . . . 0.0 109.735 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -62.34 -40.29 95.89 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 119.313 0.961 . . . . 0.0 110.667 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -52.73 64.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 4.5 m-85 -63.22 -45.6 90.9 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.671 0.788 . . . . 0.0 111.296 -177.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -52.46 -49.04 65.44 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.764 2.426 . . . . 0.0 109.477 175.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 10.7 t -60.7 -41.36 95.03 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.146 0.579 . . . . 0.0 111.9 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 479' ' ' LEU . 86.5 mt -67.76 -34.74 77.41 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.681 -1.262 . . . . 0.0 110.788 178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 77.8 mt -70.82 -39.72 72.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.271 1.428 . . . . 0.0 110.551 176.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.06 -48.01 77.89 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.231 1.412 . . . . 0.0 108.865 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.6 -48.03 80.53 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 123.473 0.709 . . . . 0.0 109.575 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -62.26 -42.04 98.98 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.739 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -55.41 -50.08 70.69 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 118.604 -0.713 . . . . 0.0 110.104 173.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.16 90.07 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 119.448 1.022 . . . . 0.0 109.549 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -66.36 -35.89 81.5 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.267 0.556 . . . . 0.0 110.202 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.511 HD12 ' C ' ' A' ' 554' ' ' LEU 0.282 0.2 OUTLIER -77.15 -39.64 48.43 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.332 1.053 . . . . 0.0 111.028 176.991 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.1 mm -66.59 -33.16 61.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 120.965 1.711 . . . . 0.0 108.791 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.05 71.79 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.296 -1.503 . . . . 0.0 110.045 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 13.3 mtp-105 -74.01 -8.24 55.38 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 117.043 -1.456 . . . . 0.0 111.957 173.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -61.82 1.82 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 123.144 2.702 . . . . 0.0 111.77 174.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -68.04 -18.66 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.108 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 75.1 p -95.98 -88.52 0.27 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -66.7 -56.93 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.575 1.15 . . . . 0.0 112.343 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 127.21 121.26 2.42 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.542 1.544 . . . . 0.0 110.557 -174.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.93 150.9 37.43 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.442 1.121 . . . . 0.0 112.013 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 35.4 t -78.14 164.59 24.84 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.789 1.635 . . . . 0.0 108.231 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.96 -42.04 99.71 Favored 'General case' 0 C--O 1.226 -0.164 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -69.64 -50.43 44.28 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 -176.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -60.49 -33.82 73.15 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.86 -0.525 . . . . 0.0 111.382 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . 0.512 ' HA ' HD12 ' A' ' 571' ' ' LEU . 52.9 ttt85 -66.22 -34.21 77.5 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.301 -0.875 . . . . 0.0 109.974 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 80.9 mt -73.09 -34.33 66.14 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.638 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -53.92 -36.43 62.74 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.328 0.967 . . . . 0.0 109.305 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 568' ' ' ARG . 6.3 mt -61.71 -39.32 91.08 Favored 'General case' 0 CA--C 1.519 -0.222 0 O-C-N 120.822 -1.174 . . . . 0.0 112.426 175.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -45.88 91.17 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.037 1.744 . . . . 0.0 108.148 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 3.7 m -66.37 -49.55 66.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 123.81 0.694 . . . . 0.0 109.285 -174.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 6.2 tp -55.1 -43.35 73.91 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.171 1.788 . . . . 0.0 111.286 175.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -64.56 -39.34 93.57 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.903 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -73.37 -34.15 65.42 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.649 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -67.04 -37.19 83.65 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 119.407 1.003 . . . . 0.0 109.469 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.0 mt . . . . . 0 C--O 1.242 0.691 0 O-C-N 120.487 -1.383 . . . . 0.0 109.718 -178.975 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . 0.501 ' O ' HD12 ' A' ' 455' ' ' ILE . 10.1 mtm . . . . . 0 CA--C 1.542 0.672 0 CA-C-O 121.914 0.864 . . . . 0.0 111.626 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -112.06 -55.12 2.55 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 124.698 1.199 . . . . 0.0 108.464 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.7 mm -56.76 -46.81 83.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -54.51 -55.12 32.35 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.378 0.99 . . . . 0.0 110.356 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 1.088 HD13 HD23 ' A' ' 484' ' ' LEU . 23.2 mt -65.34 -49.04 80.86 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.933 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.2 -38.88 96.35 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 124.048 0.833 . . . . 0.0 111.929 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.568 HD22 ' HB1' ' A' ' 531' ' ' ALA . 52.1 mt -66.37 -45.15 81.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -34.45 71.26 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.99 0.916 . . . . 0.0 111.871 174.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.23 -53.9 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 124.913 1.285 . . . . 0.0 109.942 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -80.63 -20.94 42.02 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 122.141 -0.35 . . . . 0.0 111.32 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.584 ' HB3' HD12 ' A' ' 464' ' ' LEU . 17.7 t-20 -130.07 81.05 69.75 Favored Pre-proline 0 C--N 1.323 -0.549 0 C-N-CA 124.001 0.921 . . . . 0.0 108.993 -173.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . 0.423 ' HB3' HD23 ' A' ' 498' ' ' LEU . 36.2 Cg_endo -64.56 -22.54 64.93 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.994 1.796 . . . . 0.0 111.21 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.16 -22.58 62.96 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.155 0.982 . . . . 0.0 110.686 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 461' ' ' ASN . 38.8 mt -63.67 -12.11 31.3 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.7 -1.25 . . . . 0.0 111.362 173.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -66.76 -28.05 68.09 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 120.907 -1.12 . . . . 0.0 111.209 174.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 31.9 m -83.65 -21.83 32.34 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.904 0.882 . . . . 0.0 110.906 173.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -14.8 47.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.777 0.717 . . . . 0.0 112.773 175.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 489' ' ' VAL . 5.7 p -77.79 145.48 70.66 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 120.166 1.348 . . . . 0.0 109.21 176.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.556 ' HD2' HD11 ' A' ' 539' ' ' LEU . 13.3 Cg_endo -68.67 170.43 15.24 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.513 2.809 . . . . 0.0 111.483 173.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -74.46 12.92 0.99 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.413 2.742 . . . . 0.0 114.277 175.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.639 ' HG ' HD12 ' A' ' 474' ' ' LEU . 6.6 mp 72.46 43.07 0.5 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.153 2.181 . . . . 0.0 112.698 174.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -65.81 -30.76 71.44 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -126.06 17.41 7.85 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.566 1.546 . . . . 0.0 110.536 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.639 HD12 ' HG ' ' A' ' 471' ' ' LEU . 61.3 mt -100.85 -101.68 0.25 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.246 1.019 . . . . 0.0 109.173 178.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.3 t0 70.97 147.15 0.07 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 128.141 2.577 . . . . 0.0 109.979 -173.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.85 -25.85 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.844 1.658 . . . . 0.0 109.622 173.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.16 -33.55 71.04 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 122.969 0.508 . . . . 0.0 111.229 175.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 546' ' ' LEU . 54.9 mttt -92.38 -24.33 18.93 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 112.26 0.466 . . . . 0.0 112.26 176.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 546' ' ' LEU . 0.9 OUTLIER -125.84 96.15 38.36 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -177.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.16 67.31 4.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.579 2.852 . . . . 0.0 111.394 -174.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 163.52 -23.33 0.18 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 127.019 2.247 . . . . 0.0 112.308 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.1 tp -60.66 -23.98 65.23 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.633 -0.922 . . . . 0.0 110.814 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -49.07 -35.26 18.46 Favored Glycine 0 C--O 1.222 -0.655 0 CA-C-N 119.136 0.88 . . . . 0.0 111.326 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . 1.088 HD23 HD13 ' A' ' 455' ' ' ILE . 6.4 tp -61.16 -43.44 98.87 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.72 1.26 . . . . 0.0 111.337 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.33 -51.25 61.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 124.572 1.149 . . . . 0.0 110.845 176.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -53.84 -50.6 65.85 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.596 0.634 . . . . 0.0 111.12 -178.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -50.91 69.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 117.851 0.296 . . . . 0.0 110.964 174.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 468' ' ' VAL . 73.9 t -62.1 -45.61 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.264 176.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -55.61 -46.37 77.34 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.324 1.05 . . . . 0.0 109.353 -176.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 95.5 m -61.67 -46.77 88.29 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.178 2.191 . . . . 0.0 110.654 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 69.4 m -63.14 -44.16 96.33 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.155 0.889 . . . . 0.0 110.321 -178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -23.18 64.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.105 1.362 . . . . 0.0 112.085 174.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.28 -51.23 8.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.169 1.388 . . . . 0.0 110.293 177.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -71.3 100.48 0.3 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 127.062 2.145 . . . . 0.0 110.504 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.43 115.01 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.287 2.658 . . . . 0.0 111.574 -173.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.58 34.01 54.76 Favored Glycine 0 CA--C 1.522 0.478 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.252 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.633 HD21 HD13 ' A' ' 503' ' ' LEU . 15.9 tp -54.74 154.43 5.06 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.643 0.735 . . . . 0.0 110.242 174.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.96 163.98 26.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.2 1.4 . . . . 0.0 108.565 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -52.76 -45.32 67.01 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.911 0.884 . . . . 0.0 110.583 175.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -80.24 -31.96 36.62 Favored Glycine 0 C--N 1.338 0.691 0 CA-C-O 118.899 -0.945 . . . . 0.0 111.081 -176.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -40.24 95.71 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 118.363 1.081 . . . . 0.0 108.751 174.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.633 HD13 HD21 ' A' ' 498' ' ' LEU . 16.5 tp -52.93 -53.08 54.75 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.906 0.776 . . . . 0.0 109.562 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.69 -40.72 84.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.102 0.41 . . . . 0.0 111.661 176.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.14 -40.14 96.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.759 0.423 . . . . 0.0 111.078 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -67.4 -20.57 65.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.359 1.464 . . . . 0.0 111.646 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . 0.525 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 66.5 m-85 -108.15 17.54 22.17 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.695 1.598 . . . . 0.0 109.217 176.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 15.5 ttt180 -59.7 133.88 56.5 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 119.901 -1.749 . . . . 0.0 110.166 -175.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 63.43 18.71 61.38 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 121.712 -0.618 . . . . 0.0 113.256 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.811 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.7 m -93.12 140.79 29.13 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -178.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -20.45 16.73 Favored 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.811 ' H ' HG22 ' A' ' 510' ' ' THR . 1.1 m120 -94.16 -19.5 20.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.068 1.347 . . . . 0.0 109.715 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.98 -45.53 31.65 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -53.75 -43.81 69.44 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.949 1.3 . . . . 0.0 112.1 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.5 m -62.85 -49.82 73.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.562 0.745 . . . . 0.0 109.042 173.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.1 mt -62.16 -35.73 79.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.404 1.081 . . . . 0.0 112.558 -178.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -34.29 62.07 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.583 2.353 . . . . 0.0 108.75 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.2 -43.31 98.51 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 173.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 24.4 mt -71.17 -22.39 62.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.548 1.139 . . . . 0.0 110.626 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 41.1 t -62.34 -53.99 46.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 120.744 1.611 . . . . 0.0 109.496 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.82 20.28 4.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.875 1.27 . . . . 0.0 111.397 -175.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -70.57 126.76 30.52 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.386 0.674 . . . . 0.0 111.324 -173.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.05 -2.45 37.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.06 1.344 . . . . 0.0 111.424 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -68.74 -27.68 66.14 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.818 -1.176 . . . . 0.0 111.988 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.82 -67.32 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 C-N-CA 126.026 1.731 . . . . 0.0 107.974 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 37.94 52.02 1.46 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.586 1.554 . . . . 0.0 112.14 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -148.27 167.84 24.09 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.947 1.299 . . . . 0.0 109.464 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -120.63 -32.41 4.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.091 2.156 . . . . 0.0 111.597 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -83.38 -55.05 4.54 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.261 1.424 . . . . 0.0 109.413 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.92 -25.89 39.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.568 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -53.9 -54.03 44.35 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.134 174.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -57.83 -46.03 85.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.19 0.995 . . . . 0.0 110.67 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -66.55 -46.92 74.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.767 -0.583 . . . . 0.0 110.104 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 41.6 m -62.25 -28.05 69.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.513 1.525 . . . . 0.0 110.453 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.467 ' CD1' HD13 ' A' ' 464' ' ' LEU . 43.0 t80 -66.23 -57.66 7.08 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 120.957 1.708 . . . . 0.0 108.641 176.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 17.8 m -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.346 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -63.91 -46.81 83.15 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.452 1.024 . . . . 0.0 111.758 177.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 29.3 t -65.72 -48.74 70.94 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.032 1.333 . . . . 0.0 110.59 177.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.556 HD11 ' HD2' ' A' ' 469' ' ' PRO . 2.4 tt -55.27 -52.4 63.54 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-O 117.544 -1.217 . . . . 0.0 109.031 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -59.99 -40.19 88.33 Favored 'General case' 0 C--O 1.214 -0.798 0 O-C-N 124.04 0.838 . . . . 0.0 109.927 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -66.34 -32.8 74.42 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.492 1.042 . . . . 0.0 110.395 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 2.3 ttm -66.92 -58.99 3.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.442 ' CD1' HD21 ' A' ' 474' ' ' LEU . 25.7 m-85 -57.88 -45.16 86.8 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.906 1.283 . . . . 0.0 110.166 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -55.6 -50.52 69.9 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.245 1.818 . . . . 0.0 109.513 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 5.0 t -57.97 -42.09 84.29 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 118.552 0.615 . . . . 0.0 110.187 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 479' ' ' LEU . 17.6 mt -72.57 -35.2 67.89 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.371 0.987 . . . . 0.0 110.519 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 26.5 mt -67.95 -40.0 83.34 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.241 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -62.19 -58.33 8.17 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 126.242 1.817 . . . . 0.0 108.379 174.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.98 -54.83 40.04 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.768 1.627 . . . . 0.0 109.814 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -49.85 76.16 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 124.88 1.272 . . . . 0.0 110.1 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . 0.427 ' O ' HD23 ' A' ' 554' ' ' LEU . 0.5 OUTLIER -49.59 -56.02 11.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 116.245 -1.836 . . . . 0.0 108.656 173.634 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -60.3 -35.41 75.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.266 1.393 . . . . 0.0 109.956 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -44.81 88.86 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 121.565 -0.709 . . . . 0.0 111.197 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 571' ' ' LEU 0.267 0.0 OUTLIER -80.07 -44.81 19.4 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.372 177.689 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -39.6 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.942 1.701 . . . . 0.0 108.043 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . 0.501 ' O ' HG22 ' A' ' 560' ' ' THR . . . -58.76 -39.43 80.95 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.636 -1.29 . . . . 0.0 109.759 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.51 -13.08 18.12 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 116.014 -1.946 . . . . 0.0 110.01 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . 0.584 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -72.47 -58.04 3.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 122.306 2.321 . . . . 0.0 109.256 173.574 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -63.59 -27.69 69.42 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . 0.502 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.6 t -99.6 -82.4 0.44 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . 0.502 ' H ' HG23 ' A' ' 560' ' ' THR . 1.6 t-80 -58.48 -40.95 84.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.049 -1.432 . . . . 0.0 113.798 -173.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 98.21 119.29 4.01 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -174.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 558' ' ' GLU . 1.0 OUTLIER -92.75 152.48 19.46 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 173.431 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.2 t -73.05 165.09 25.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -37.54 74.49 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.451 -0.781 . . . . 0.0 111.385 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -75.61 -53.21 8.95 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 124.532 1.145 . . . . 0.0 110.648 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . 0.633 ' O ' HD22 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -58.75 -40.43 83.82 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 118.96 0.8 . . . . 0.0 111.17 177.689 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -59.53 -33.61 71.6 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.138 1.335 . . . . 0.0 109.794 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 19.1 mt -72.36 -37.15 68.87 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 116.715 -1.612 . . . . 0.0 110.068 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.77 -41.1 43.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.841 1.655 . . . . 0.0 109.431 174.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 554' ' ' LEU . 0.8 OUTLIER -68.86 -38.35 79.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.949 -177.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -47.25 74.19 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 119.512 1.051 . . . . 0.0 109.018 173.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -52.55 63.51 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . 0.412 HD22 ' HG3' ' A' ' 551' ' ' GLN . 7.1 tt -55.43 -36.44 66.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.284 1.434 . . . . 0.0 111.288 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -61.21 -39.76 91.45 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.155 -1.591 . . . . 0.0 111.474 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -78.41 -25.05 45.98 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.857 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -66.99 -38.95 86.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.558 1.143 . . . . 0.0 109.503 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 17.0 mt . . . . . 0 N--CA 1.475 0.78 0 C-N-CA 124.882 1.273 . . . . 0.0 112.683 173.887 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 451' ' ' MET . . . . . 0.728 ' HE1' HD12 ' A' ' 482' ' ' LEU . 53.2 tpp . . . . . 0 CA--C 1.539 0.541 0 CA-C-O 123.711 1.72 . . . . 0.0 110.721 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.01 -51.29 0.23 Allowed 'General case' 0 CA--C 1.486 -1.491 0 CA-C-O 117.007 -1.473 . . . . 0.0 108.848 -175.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 453' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 534' ' ' THR . 7.4 mm -58.74 -52.6 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 124.946 1.404 . . . . 0.0 107.709 176.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . 0.435 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 2.7 mt -56.78 -47.13 80.87 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 118.74 0.7 . . . . 0.0 110.75 -175.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' ILE . . . . . 0.403 HG22 HD13 ' A' ' 519' ' ' LEU . 26.5 mt -62.22 -59.31 4.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 C-N-CA 123.851 0.86 . . . . 0.0 111.606 174.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.85 -38.14 96.04 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 120.833 1.651 . . . . 0.0 113.233 -173.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . 0.96 HD21 HG21 ' A' ' 525' ' ' ILE . 47.2 mt -68.9 -38.16 79.44 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.776 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 492' ' ' CYS . 2.6 tm? -65.96 -36.02 82.2 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.771 1.169 . . . . 0.0 109.86 173.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.7 t -60.91 -51.6 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 O-C-N 120.561 -1.337 . . . . 0.0 109.041 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.25 -20.24 55.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.719 0.807 . . . . 0.0 112.067 177.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' ASN . . . . . 0.512 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.2 OUTLIER -134.53 74.69 65.2 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 119.031 0.832 . . . . 0.0 109.316 -178.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' PRO . . . . . 0.583 ' CB ' HD23 ' A' ' 498' ' ' LEU . 24.3 Cg_endo -68.31 -18.52 44.5 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.575 1.516 . . . . 0.0 112.119 -175.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -65.84 -15.06 62.55 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.693 1.197 . . . . 0.0 110.857 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 535' ' ' PHE . 43.1 mt -70.31 -12.28 61.48 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 120.437 -1.415 . . . . 0.0 109.01 173.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -58.82 -44.73 90.93 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.944 0.793 . . . . 0.0 109.195 173.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.6 m -70.3 -24.73 63.08 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.642 -1.286 . . . . 0.0 112.979 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.2 mt -83.92 -6.02 59.33 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.222 1.809 . . . . 0.0 111.393 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' VAL . . . . . 0.644 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.6 OUTLIER -93.82 157.87 37.38 Favored Pre-proline 0 CA--C 1.547 0.854 0 CA-C-N 121.041 1.746 . . . . 0.0 107.062 177.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' PRO . . . . . 0.644 ' HD2' HG22 ' A' ' 468' ' ' VAL . 19.1 Cg_endo -74.69 174.68 12.25 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.199 2.599 . . . . 0.0 111.076 173.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.58 8.73 2.14 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 124.777 3.651 . . . . 0.0 114.215 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' LEU . . . . . 0.875 HD12 HD21 ' A' ' 482' ' ' LEU . 2.2 mm? 63.69 55.22 1.72 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 129.367 3.067 . . . . 0.0 111.919 178.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.22 -39.71 11.39 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.699 0.8 . . . . 0.0 112.383 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -84.22 6.9 20.92 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 120.687 -1.258 . . . . 0.0 113.851 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -128.66 -71.41 0.64 Allowed 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 125.569 1.547 . . . . 0.0 109.622 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 6.5 t70 60.71 162.61 0.06 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-O 122.909 1.338 . . . . 0.0 112.311 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -74.81 -14.63 60.71 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 120.569 -1.332 . . . . 0.0 111.107 178.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -63.28 -42.39 99.09 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.766 1.226 . . . . 0.0 109.752 174.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -49.4 22.15 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 118.941 -1.104 . . . . 0.0 108.328 -176.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' LEU . . . . . 1.007 HD23 HD13 ' A' ' 482' ' ' LEU . 0.1 OUTLIER -117.2 118.12 36.11 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.56 -173.778 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -72.3 -2.08 11.14 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.266 1.978 . . . . 0.0 112.614 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -107.0 -7.55 33.01 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.831 1.205 . . . . 0.0 110.621 173.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' LEU . . . . . 1.007 HD13 HD23 ' A' ' 479' ' ' LEU . 2.9 tp -63.12 -32.69 74.13 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 116.441 -1.742 . . . . 0.0 108.742 177.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -52.4 -48.13 55.16 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 124.392 1.058 . . . . 0.0 110.775 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -44.32 97.0 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 121.547 -0.972 . . . . 0.0 111.928 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 32.8 t80 -66.19 -42.53 88.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.271 0.628 . . . . 0.0 110.984 177.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -64.64 -48.21 75.67 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 116.679 -1.629 . . . . 0.0 107.254 -176.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.25 -44.2 97.08 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 125.497 1.519 . . . . 0.0 109.886 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.508 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -55.47 -53.43 56.38 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.258 0.623 . . . . 0.0 111.005 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' VAL . . . . . 0.608 HG11 HG11 ' A' ' 468' ' ' VAL . 48.4 t -60.59 -46.78 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 116.214 -1.851 . . . . 0.0 110.361 174.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.03 -45.9 82.78 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 121.938 2.154 . . . . 0.0 110.361 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.8 m -62.34 -47.44 84.19 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 126.469 1.908 . . . . 0.0 109.2 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' CYS . . . . . 0.539 ' SG ' HD11 ' A' ' 458' ' ' LEU . 90.7 m -60.28 -38.58 84.03 Favored 'General case' 0 CA--C 1.555 1.152 0 CA-C-N 119.182 0.901 . . . . 0.0 111.854 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 465' ' ' ALA . 0.7 OUTLIER -60.33 -21.26 61.83 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 129.058 2.943 . . . . 0.0 111.517 175.192 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 23.5 t -89.45 -64.82 1.09 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' GLN . . . . . 0.524 HE22 ' CD2' ' A' ' 506' ' ' HIS . 0.3 OUTLIER -57.2 98.4 0.15 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 125.437 1.495 . . . . 0.0 114.124 -173.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -70.48 127.85 14.58 Favored 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.155 1.903 . . . . 0.0 109.963 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 59.77 42.89 98.23 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' LEU . . . . . 0.583 HD23 ' CB ' ' A' ' 462' ' ' PRO . 10.9 tp -56.26 159.53 3.47 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.398 1.094 . . . . 0.0 109.009 174.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' THR . . . . . 0.43 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 0.2 OUTLIER -125.4 163.48 22.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 177.772 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.3 m -53.02 -44.5 67.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.781 1.232 . . . . 0.0 109.514 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -73.58 -41.91 42.08 Favored Glycine 0 N--CA 1.442 -0.911 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.43 ' HB3' ' H ' ' A' ' 499' ' ' THR . 4.1 tp-100 -58.93 -31.38 68.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 124.626 1.17 . . . . 0.0 111.849 -176.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 35.4 tp -64.64 -57.35 9.29 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 174.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' LEU . . . . . 0.55 HD21 ' HA ' ' A' ' 517' ' ' GLU . 7.9 mp -59.36 -33.17 70.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.236 0.471 . . . . 0.0 112.062 179.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.04 -48.46 65.57 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.497 1.119 . . . . 0.0 109.805 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' HIS . . . . . 0.524 ' CD2' HE22 ' A' ' 495' ' ' GLN . 68.5 t60 -63.29 -16.48 60.43 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.734 0.813 . . . . 0.0 112.417 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -111.94 16.18 20.43 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.269 1.827 . . . . 0.0 108.969 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -54.86 124.51 16.83 Favored 'General case' 0 C--O 1.227 -0.109 0 O-C-N 120.287 -1.508 . . . . 0.0 108.749 -177.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.77 37.48 61.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.821 -0.433 . . . . 0.0 112.03 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' THR . . . . . 0.826 HG22 ' H ' ' A' ' 512' ' ' ASN . 28.9 m -108.61 152.78 24.32 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.781 1.232 . . . . 0.0 108.737 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -59.75 -25.58 64.98 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.369 1.068 . . . . 0.0 110.591 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' ASN . . . . . 0.826 ' H ' HG22 ' A' ' 510' ' ' THR . 9.7 m120 -92.31 -17.47 24.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 116.02 -1.943 . . . . 0.0 110.181 178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.99 59.3 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 120.016 1.28 . . . . 0.0 109.476 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.25 -45.71 83.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.891 0.769 . . . . 0.0 112.701 -179.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 31.1 m -66.93 -44.05 81.67 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.709 -0.62 . . . . 0.0 109.696 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' LEU . . . . . 0.508 HD21 HD11 ' A' ' 488' ' ' LEU . 61.8 mt -59.76 -40.15 87.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.539 1.536 . . . . 0.0 111.607 177.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.55 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.3 tt0 -68.49 -42.76 78.19 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 127.019 2.128 . . . . 0.0 109.216 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -61.43 -36.4 80.26 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.525 -0.734 . . . . 0.0 109.625 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 32.0 mt -82.37 -8.87 59.63 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.978 0.911 . . . . 0.0 112.246 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.9 t -77.5 -56.66 4.35 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 124.956 1.303 . . . . 0.0 108.14 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.8 12.85 1.18 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.947 1.299 . . . . 0.0 113.274 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' TRP . . . . . 0.421 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.9 t90 -68.53 128.44 36.63 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.189 -0.944 . . . . 0.0 110.903 -175.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.66 14.89 15.48 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.711 2.405 . . . . 0.0 110.043 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -65.99 -29.5 69.89 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 120.237 -1.54 . . . . 0.0 109.853 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' ILE . . . . . 0.96 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -107.63 -48.85 8.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 C-N-CA 128.441 2.696 . . . . 0.0 110.363 -179.744 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.81 34.28 0.41 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.253 2.221 . . . . 0.0 112.576 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -157.93 165.68 34.56 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.821 1.649 . . . . 0.0 108.155 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -114.56 -35.58 4.85 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.508 1.523 . . . . 0.0 109.365 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.25 -50.76 64.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.596 0.758 . . . . 0.0 110.051 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 2.3 mm -62.91 -28.5 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.615 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.44 -61.83 2.21 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 119.962 1.255 . . . . 0.0 109.111 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -54.46 -42.55 70.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.865 1.211 . . . . 0.0 110.612 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.05 -55.03 37.44 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 122.691 0.397 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' THR . . . . . 0.508 HG22 HG21 ' A' ' 453' ' ' ILE . 47.8 m -63.47 -31.71 72.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 117.414 -1.279 . . . . 0.0 109.102 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 464' ' ' LEU . 34.8 t80 -63.16 -54.71 33.45 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.09 1.768 . . . . 0.0 107.676 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 90.8 m -59.84 -48.28 82.32 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.525 0.73 . . . . 0.0 109.551 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -58.22 -46.23 86.26 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.992 1.717 . . . . 0.0 111.666 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 13.2 t -69.12 -45.42 70.2 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 126.824 2.05 . . . . 0.0 111.723 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.5 tt -59.76 -47.26 86.37 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 120.098 1.317 . . . . 0.0 110.753 173.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -59.07 -40.06 84.02 Favored 'General case' 0 C--O 1.207 -1.177 0 O-C-N 120.772 -1.205 . . . . 0.0 113.085 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -64.36 -44.29 91.91 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -52.9 63.67 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 474' ' ' LEU . 2.9 m-85 -62.29 -40.59 96.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.304 1.041 . . . . 0.0 109.523 -175.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -62.21 -53.81 49.95 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.7 t -51.0 -46.33 61.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.404 1.482 . . . . 0.0 110.817 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.753 HD21 HD11 ' A' ' 479' ' ' LEU . 80.0 mt -69.01 -39.93 79.0 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 119.399 0.999 . . . . 0.0 111.121 -177.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.416 ' HB3' HD11 ' A' ' 578' ' ' LEU . 20.2 mt -66.31 -37.29 85.04 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.997 -1.478 . . . . 0.0 110.255 174.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.29 -56.32 13.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.789 2.036 . . . . 0.0 107.818 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 15.6 mt -59.34 -47.1 86.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.66 1.584 . . . . 0.0 108.244 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -47.13 72.54 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' GLN . . . . . 0.461 ' HG3' HD12 ' A' ' 571' ' ' LEU . 27.8 tt0 -50.84 -55.75 15.48 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-O 114.097 -2.859 . . . . 0.0 107.798 175.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.08 -44.31 91.87 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 125.811 1.944 . . . . 0.0 110.21 -174.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -48.31 74.05 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.71 1.204 . . . . 0.0 109.61 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' LEU . . . . . 1.003 HD11 HD21 ' A' ' 571' ' ' LEU 0.252 0.2 OUTLIER -66.06 -44.33 84.83 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.818 -1.176 . . . . 0.0 109.207 176.236 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.3 mm -64.25 -38.58 82.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 120.567 1.531 . . . . 0.0 108.334 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.28 -38.73 66.2 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.657 1.983 . . . . 0.0 107.624 174.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -2.15 1.85 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 116.659 -1.639 . . . . 0.0 112.582 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' GLU . . . . . 0.55 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.5 OUTLIER -82.92 -27.24 30.76 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.625 1.557 . . . . 0.0 111.338 173.091 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -107.44 -30.28 8.76 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.642 1.11 . . . . 0.0 111.27 -177.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.8 p -77.22 -51.6 10.66 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -114.3 -36.66 4.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.224 1.41 . . . . 0.0 111.829 -176.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 102.96 128.4 6.36 Favored Glycine 0 C--N 1.339 0.727 0 C-N-CA 125.574 1.559 . . . . 0.0 110.124 -173.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' LEU . . . . . 0.55 HD12 ' HB2' ' A' ' 558' ' ' GLU . 5.0 mt -87.4 153.23 21.6 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 173.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.75 168.52 11.24 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.282 178.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -58.14 -41.45 83.74 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -76.08 -53.61 8.08 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 123.276 0.63 . . . . 0.0 109.786 -178.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 567' ' ' GLU . . . . . 0.465 ' HB3' HD22 ' A' ' 563' ' ' LEU . 8.5 mt-10 -60.78 -36.07 78.06 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.907 -177.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -59.56 -39.08 82.87 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 120.094 1.315 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 1.5 mp -74.94 -38.24 61.8 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 117.531 -1.223 . . . . 0.0 111.99 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -47.52 -40.8 19.57 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 120.244 1.384 . . . . 0.0 107.875 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' LEU . . . . . 1.003 HD21 HD11 ' A' ' 554' ' ' LEU . 4.5 mm? -72.12 -34.93 68.96 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 115.971 -1.966 . . . . 0.0 110.978 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -48.29 75.82 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 121.109 1.777 . . . . 0.0 107.886 173.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -26.27 68.22 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 578' ' ' LEU . 8.0 tt -81.72 -34.08 30.76 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.556 1.542 . . . . 0.0 109.865 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.67 -44.78 92.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.82 1.648 . . . . 0.0 109.317 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -30.09 68.1 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.72 -35.2 67.5 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.429 -174.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' LEU . . . . . 0.508 HD12 HD23 ' A' ' 574' ' ' LEU . 13.9 mt . . . . . 0 N--CA 1.472 0.641 0 C-N-CA 125.39 1.476 . . . . 0.0 112.891 173.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 11.8 pttt . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 122.702 1.239 . . . . 0.0 109.408 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -103.2 169.6 8.46 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 128.478 2.711 . . . . 0.0 108.211 173.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . 0.45 HG23 ' OG ' ' A' ' 538' ' ' SER . 44.8 m -45.77 -67.39 0.29 Allowed 'General case' 0 CA--C 1.537 0.468 0 C-N-CA 127.986 2.515 . . . . 0.0 111.586 173.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . 0.262 1.1 m 57.49 175.09 0.05 OUTLIER 'General case' 0 CA--C 1.551 0.991 0 CA-C-O 122.058 0.932 . . . . 0.0 109.81 -174.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -72.16 15.7 0.15 Allowed 'General case' 0 CA--C 1.538 0.488 0 O-C-N 119.018 -2.301 . . . . 0.0 111.35 174.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . 0.477 ' HB3' ' CH2' ' A' ' 522' ' ' TRP . 16.4 mtt180 -86.27 -50.63 6.81 Favored 'General case' 0 CA--C 1.507 -0.703 0 O-C-N 120.234 -1.541 . . . . 0.0 109.362 -179.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 16.0 mm -63.15 -52.45 58.76 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.259 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 -177.589 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.5 mt -54.1 -42.43 69.38 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 119.486 1.039 . . . . 0.0 111.656 -178.427 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 68.5 mt -72.96 -58.61 4.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.463 0 CA-C-N 118.719 0.691 . . . . 0.0 110.264 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.21 -32.65 60.36 Favored Glycine 0 CA--C 1.523 0.59 0 C-N-CA 124.344 0.973 . . . . 0.0 112.383 -175.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.44 HD22 ' HA ' ' A' ' 531' ' ' ALA . 64.9 mt -69.14 -49.55 55.93 Favored 'General case' 0 N--CA 1.448 -0.538 0 CA-C-N 117.527 0.663 . . . . 0.0 109.664 173.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.63 -38.43 75.0 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.67 0.788 . . . . 0.0 111.346 177.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 24.6 t -60.31 -55.43 24.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.235 0 C-N-CA 125.069 1.348 . . . . 0.0 109.241 175.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . 0.587 ' HA ' HG23 ' A' ' 500' ' ' THR . 2.4 mp0 -70.06 -20.82 63.21 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 118.823 -0.608 . . . . 0.0 112.43 -178.28 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 54.9 t-20 -141.58 80.07 16.5 Favored Pre-proline 0 CA--C 1.533 0.294 0 C-N-CA 125.712 1.605 . . . . 0.0 110.369 -175.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.81 -15.34 40.51 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 121.467 1.445 . . . . 0.0 112.897 -175.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -68.14 -18.94 64.76 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.824 1.193 . . . . 0.0 110.214 175.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.408 HD13 ' CD1' ' A' ' 535' ' ' PHE . 79.6 mt -63.48 -13.37 39.99 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 121.33 -0.856 . . . . 0.0 110.827 173.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.446 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.03 -26.48 68.29 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 118.789 0.722 . . . . 0.0 111.115 173.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 90.6 m -82.92 -17.48 43.51 Favored 'General case' 0 CA--C 1.541 0.621 0 CA-C-N 119.595 1.089 . . . . 0.0 110.854 174.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.73 -8.34 50.1 Favored 'General case' 0 C--O 1.232 0.172 0 C-N-CA 124.112 0.965 . . . . 0.0 111.375 -179.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 489' ' ' VAL . 9.9 p -88.47 145.47 35.58 Favored Pre-proline 0 CA--C 1.546 0.789 0 CA-C-N 119.82 1.191 . . . . 0.0 108.488 -178.374 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.4 Cg_endo -68.01 170.98 13.17 Favored 'Trans proline' 0 CA--C 1.542 0.877 0 C-N-CA 123.566 2.844 . . . . 0.0 111.484 174.45 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.09 13.95 0.59 Allowed 'Trans proline' 0 CA--C 1.542 0.924 0 C-N-CA 124.467 3.445 . . . . 0.0 113.933 174.603 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.627 ' HA ' HD13 ' A' ' 474' ' ' LEU . 9.6 mp 64.05 18.35 11.17 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.645 1.978 . . . . 0.0 115.935 173.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -47.1 -42.22 18.66 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 125.712 1.605 . . . . 0.0 114.78 -178.339 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.26 6.59 48.63 Favored 'General case' 0 N--CA 1.468 0.441 0 C-N-CA 123.908 0.883 . . . . 0.0 112.633 -175.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.797 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.2 mp -115.06 -71.83 0.72 Allowed 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 125.662 1.585 . . . . 0.0 108.595 -173.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 16.5 t70 59.97 166.9 0.07 Allowed 'General case' 0 CA--C 1.543 0.693 0 CA-C-O 123.256 1.503 . . . . 0.0 110.118 -173.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -83.3 -6.19 59.39 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 119.688 -1.882 . . . . 0.0 110.605 178.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.8 t-20 -81.91 -44.85 16.26 Favored 'General case' 0 N--CA 1.45 -0.452 0 C-N-CA 125.72 1.608 . . . . 0.0 112.021 178.068 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.4 mttm -76.36 -21.2 56.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 119.072 -0.489 . . . . 0.0 111.662 -174.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 52.9 mt -125.27 96.5 39.17 Favored Pre-proline 0 C--O 1.234 0.258 0 CA-C-O 118.141 -0.933 . . . . 0.0 108.692 -178.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -68.46 78.11 0.67 Allowed 'Trans proline' 0 CA--C 1.542 0.902 0 C-N-CA 123.792 2.995 . . . . 0.0 111.197 -176.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.96 -17.06 2.37 Favored Glycine 0 CA--C 1.53 1.029 0 C-N-CA 126.875 2.179 . . . . 0.0 113.834 -175.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 11.6 tp -56.24 -27.43 54.96 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 120.615 2.207 . . . . 0.0 110.231 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.05 -36.77 9.38 Favored Glycine 0 CA--C 1.529 0.947 0 CA-C-O 118.998 -0.89 . . . . 0.0 112.816 174.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -63.49 -47.44 81.73 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 119.752 1.776 . . . . 0.0 110.276 175.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -59.74 -49.99 75.59 Favored 'General case' 0 N--CA 1.465 0.322 0 C-N-CA 124.376 1.07 . . . . 0.0 110.658 174.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.9 tmt_? -61.77 -45.88 91.99 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 117.959 -1.02 . . . . 0.0 109.439 -175.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 18.9 tt0 -57.46 -52.84 63.77 Favored 'General case' 0 C--O 1.221 -0.404 0 N-CA-C 108.124 -1.065 . . . . 0.0 108.124 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.782 HD11 HD21 ' A' ' 516' ' ' LEU . 0.0 OUTLIER -55.69 -48.66 74.73 Favored 'General case' 0 C--O 1.226 -0.165 0 C-N-CA 122.851 0.46 . . . . 0.0 112.028 -177.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.655 HG11 HG11 ' A' ' 468' ' ' VAL . 75.3 t -58.79 -49.88 81.31 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.156 0 N-CA-C 108.855 -0.794 . . . . 0.0 108.855 175.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -58.06 -46.37 85.52 Favored 'General case' 0 C--O 1.225 -0.19 0 C-N-CA 124.928 1.291 . . . . 0.0 109.942 -175.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.7 m -62.81 -41.51 99.33 Favored 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 126.499 1.92 . . . . 0.0 110.785 174.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 44.3 m -62.14 -45.35 93.85 Favored 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 120.388 1.449 . . . . 0.0 110.38 176.15 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -64.17 -23.91 67.49 Favored 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 123.983 0.913 . . . . 0.0 112.253 174.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -82.24 -15.29 53.6 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.618 1.167 . . . . 0.0 111.535 176.815 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -124.9 75.82 66.16 Favored Pre-proline 0 CA--C 1.535 0.391 0 C-N-CA 124.984 1.314 . . . . 0.0 108.776 -176.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -62.41 121.39 9.35 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.021 1.814 . . . . 0.0 109.474 179.8 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 98.47 8.24 54.97 Favored Glycine 0 CA--C 1.53 0.992 0 C-N-CA 124.375 0.988 . . . . 0.0 113.421 -176.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.01 152.55 36.57 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 118.435 1.118 . . . . 0.0 108.027 173.257 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 7.3 p -134.03 169.53 17.0 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.151 0.98 . . . . 0.0 109.031 -174.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.587 HG23 ' HA ' ' A' ' 460' ' ' GLN . 5.1 m -49.88 -48.33 51.47 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.607 1.563 . . . . 0.0 111.509 174.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -82.94 -41.45 8.69 Favored Glycine 0 CA--C 1.527 0.839 0 N-CA-C 109.518 -1.433 . . . . 0.0 109.518 -174.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 51.4 tp60 -63.6 -24.84 67.97 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 124.449 1.1 . . . . 0.0 111.296 -178.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 68.4 tp -55.58 -50.3 70.45 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.676 1.19 . . . . 0.0 110.451 174.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.61 -35.06 79.77 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . 0.563 ' OE1' ' HD3' ' A' ' 508' ' ' ARG . 1.0 OUTLIER -70.98 -31.59 68.18 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 117.85 0.295 . . . . 0.0 110.217 178.541 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 62.7 t60 -70.12 -20.71 63.16 Favored 'General case' 0 CA--C 1.539 0.553 0 O-C-N 121.21 -0.931 . . . . 0.0 112.437 174.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.0 m-85 -112.57 17.22 19.39 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 126.034 1.733 . . . . 0.0 109.751 177.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . 0.563 ' HD3' ' OE1' ' A' ' 505' ' ' GLU . 6.6 tpt180 -55.13 120.36 6.86 Favored 'General case' 0 N--CA 1.456 -0.155 0 O-C-N 120.785 -1.197 . . . . 0.0 109.98 -174.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.43 18.25 78.13 Favored Glycine 0 CA--C 1.531 1.069 0 CA-C-O 118.641 -1.088 . . . . 0.0 113.542 176.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.827 HG22 ' H ' ' A' ' 512' ' ' ASN . 30.0 m -92.79 150.59 20.53 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 119.545 1.672 . . . . 0.0 107.998 -175.443 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 32.9 t30 -57.72 -20.83 37.27 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-O 121.897 0.856 . . . . 0.0 112.385 176.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.827 ' H ' HG22 ' A' ' 510' ' ' THR . 11.6 m-20 -93.39 -17.91 22.97 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 124.819 1.247 . . . . 0.0 109.703 -177.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -54.29 -38.44 65.91 Favored 'General case' 0 C--O 1.214 -0.815 0 C-N-CA 125.208 1.403 . . . . 0.0 110.971 179.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.37 -44.1 88.74 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 119.822 1.192 . . . . 0.0 111.868 178.013 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 32.1 m -65.63 -43.16 90.35 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.679 0.792 . . . . 0.0 109.712 175.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.782 HD21 HD11 ' A' ' 488' ' ' LEU . 13.1 mt -66.7 -32.78 74.3 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 123.276 0.631 . . . . 0.0 112.09 179.143 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -62.19 -44.52 96.42 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 125.84 1.656 . . . . 0.0 108.413 174.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.37 -37.38 83.16 Favored 'General case' 0 C--N 1.342 0.251 0 C-N-CA 123.714 0.805 . . . . 0.0 109.899 -177.414 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -80.35 -31.04 38.02 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 125.89 1.676 . . . . 0.0 114.277 -179.407 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.4 t -70.33 -53.85 14.99 Favored 'General case' 0 C--N 1.31 -1.113 0 C-N-CA 124.989 1.315 . . . . 0.0 110.53 174.389 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.7 ppp? -71.24 9.73 0.71 Allowed 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.782 1.633 . . . . 0.0 114.03 175.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.477 ' CH2' ' HB3' ' A' ' 452' ' ' ARG . 0.8 OUTLIER -78.33 85.61 4.45 Favored 'General case' 0 N--CA 1.438 -1.044 0 C-N-CA 124.925 1.29 . . . . 0.0 113.512 -173.451 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -62.89 -2.63 1.25 Allowed 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 126.632 1.973 . . . . 0.0 112.998 173.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -70.78 -0.93 10.0 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.514 1.526 . . . . 0.0 112.503 -177.605 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -150.17 -63.14 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.629 0 C-N-CA 127.463 2.305 . . . . 0.0 109.869 -177.261 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.62 21.43 0.25 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 128.272 2.629 . . . . 0.0 116.97 173.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -116.75 177.36 4.73 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.5 1.12 . . . . 0.0 110.041 -173.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 49.3 mttp -135.11 -30.11 1.07 Allowed 'General case' 0 N--CA 1.463 0.206 0 C-N-CA 126.775 2.03 . . . . 0.0 112.011 178.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -81.81 -56.28 4.08 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.319 1.447 . . . . 0.0 109.167 174.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -59.51 -28.23 39.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 C-N-CA 124.799 1.24 . . . . 0.0 108.179 174.41 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.44 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -53.88 -50.63 65.88 Favored 'General case' 0 N--CA 1.45 -0.468 0 CA-C-N 119.002 0.819 . . . . 0.0 111.718 177.837 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -65.53 -49.95 67.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 118.829 0.74 . . . . 0.0 109.692 -175.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.17 -48.81 73.24 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.692 0.797 . . . . 0.0 110.916 177.134 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.1 m -66.23 -32.42 73.83 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 118.161 -0.923 . . . . 0.0 109.083 179.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.408 ' CD1' HD13 ' A' ' 464' ' ' LEU . 37.9 t80 -63.78 -54.1 40.5 Favored 'General case' 0 CA--C 1.514 -0.407 0 CA-C-N 120.519 1.509 . . . . 0.0 108.906 178.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 29.8 m -58.89 -45.97 88.97 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-O 118.432 -0.794 . . . . 0.0 109.385 177.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -63.57 -41.68 98.38 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 119.974 1.261 . . . . 0.0 112.165 -178.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.45 ' OG ' HG23 ' A' ' 449' ' ' THR . 5.6 t -64.21 -49.84 70.42 Favored 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 126.68 1.992 . . . . 0.0 110.334 178.069 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 3.7 tt -55.51 -50.04 71.01 Favored 'General case' 0 N--CA 1.438 -1.065 0 C-N-CA 124.65 1.18 . . . . 0.0 108.002 175.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -55.69 -44.61 77.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 123.814 0.846 . . . . 0.0 108.812 177.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 6.3 t-80 -61.84 -44.47 96.76 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.192 0.905 . . . . 0.0 110.538 179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -60.53 -51.26 70.19 Favored 'General case' 0 N--CA 1.451 -0.425 0 O-C-N 121.326 -0.858 . . . . 0.0 108.736 178.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.797 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.8 m-85 -59.96 -49.33 78.09 Favored 'General case' 0 C--O 1.218 -0.595 0 C-N-CA 123.823 0.849 . . . . 0.0 109.883 -178.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -50.39 -52.11 40.31 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 127.481 2.312 . . . . 0.0 110.092 177.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 38.1 t -58.9 -44.19 91.16 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 124.547 1.139 . . . . 0.0 112.132 176.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 30.4 mt -65.37 -39.6 92.51 Favored 'General case' 0 N--CA 1.464 0.227 0 O-C-N 120.888 -1.133 . . . . 0.0 111.355 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 23.9 mt -67.49 -38.72 84.76 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.229 1.412 . . . . 0.0 108.891 176.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 24.0 tt0 -61.25 -51.19 69.96 Favored 'General case' 0 CA--C 1.532 0.253 0 C-N-CA 125.621 1.568 . . . . 0.0 109.44 174.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 75.9 mt -57.94 -47.78 81.89 Favored 'General case' 0 C--O 1.225 -0.218 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 177.38 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 22.1 tpt180 -59.91 -45.13 93.54 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 117.742 -1.123 . . . . 0.0 109.73 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -52.91 -52.89 56.14 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 124.393 1.077 . . . . 0.0 109.853 175.417 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -64.4 -36.03 82.82 Favored 'General case' 0 N--CA 1.448 -0.546 0 C-N-CA 120.857 -0.337 . . . . 0.0 111.166 -177.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tp10 -62.03 -43.98 97.68 Favored 'General case' 0 C--O 1.233 0.219 0 C-N-CA 125.078 1.351 . . . . 0.0 111.491 175.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.443 ' HB3' HD11 ' A' ' 571' ' ' LEU . 12.2 mt -63.06 -55.26 27.0 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 124.944 1.298 . . . . 0.0 108.485 178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.06 -37.26 79.36 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 N-CA-C 109.331 -0.618 . . . . 0.0 109.331 -177.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.53 -24.8 66.87 Favored 'General case' 0 CA--C 1.529 0.139 0 O-C-N 120.084 -1.635 . . . . 0.0 111.659 174.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 72.2 mtt-85 -96.22 0.01 50.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 116.629 -1.653 . . . . 0.0 112.476 174.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -86.59 -44.72 11.68 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 121.406 1.912 . . . . 0.0 110.617 174.319 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.04 1.1 11.74 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.053 1.341 . . . . 0.0 113.471 -173.63 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.696 HG23 ' H ' ' A' ' 561' ' ' HIS . 5.1 t -139.73 -88.74 0.19 Allowed 'General case' 0 N--CA 1.446 -0.633 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 -178.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.696 ' H ' HG23 ' A' ' 560' ' ' THR . 0.7 OUTLIER -50.67 -49.64 56.76 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 123.767 0.827 . . . . 0.0 111.831 -176.876 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.79 87.79 1.38 Allowed Glycine 0 N--CA 1.439 -1.154 0 N-CA-C 107.341 -2.304 . . . . 0.0 107.341 -175.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -63.22 163.27 10.59 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 173.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 32.3 p -67.37 170.13 7.84 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.431 -0.793 . . . . 0.0 111.737 -174.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -64.21 -38.08 89.79 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 109.561 -0.533 . . . . 0.0 109.561 176.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -64.02 -49.66 71.53 Favored 'General case' 0 C--O 1.218 -0.601 0 C-N-CA 124.829 1.252 . . . . 0.0 108.624 174.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -62.09 -37.22 84.24 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 120.816 1.644 . . . . 0.0 110.637 -178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.648 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.2 OUTLIER -66.98 -30.1 70.13 Favored 'General case' 0 N--CA 1.465 0.288 0 C-N-CA 125.311 1.445 . . . . 0.0 112.541 174.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 13.5 mt -78.86 -38.68 37.27 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-O 117.529 -1.224 . . . . 0.0 109.286 173.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 19.5 tp10 -53.27 -42.35 66.43 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-N 119.508 1.049 . . . . 0.0 108.463 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.648 HD12 ' HA ' ' A' ' 568' ' ' ARG . 10.4 mt -53.09 -44.77 67.83 Favored 'General case' 0 N--CA 1.454 -0.23 0 C-N-CA 124.714 1.206 . . . . 0.0 112.736 173.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.21 -52.13 67.01 Favored 'General case' 0 C--N 1.341 0.232 0 CA-C-N 120.113 1.324 . . . . 0.0 109.182 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -59.41 -45.26 92.0 Favored 'General case' 0 CA--C 1.534 0.348 0 O-C-N 123.886 0.742 . . . . 0.0 109.861 -178.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 4.3 tp -61.17 -39.16 89.09 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.998 1.319 . . . . 0.0 111.215 179.577 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -65.77 -36.39 83.42 Favored 'General case' 0 C--O 1.227 -0.097 0 C-N-CA 123.864 0.866 . . . . 0.0 109.659 177.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -67.91 -38.46 82.97 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.442 0.697 . . . . 0.0 110.664 176.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -66.27 -36.42 82.93 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.756 0.822 . . . . 0.0 110.273 176.537 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.0 mt -80.64 -22.72 40.26 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 123.902 0.881 . . . . 0.0 109.762 -177.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -68.44 -17.94 64.32 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.019 0.528 . . . . 0.0 111.843 178.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 38.2 tptt -147.12 90.55 1.9 Allowed 'General case' 0 C--N 1.342 0.259 0 CA-C-N 119.19 0.905 . . . . 0.0 109.346 179.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.538 0.482 0 C-N-CA 124.975 1.31 . . . . 0.0 113.28 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 123.777 1.751 . . . . 0.0 110.62 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -104.54 136.57 43.85 Favored 'General case' 0 N--CA 1.439 -0.982 0 N-CA-C 104.02 -2.585 . . . . 0.0 104.02 -177.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 12.5 m -58.09 164.02 2.55 Favored 'General case' 0 CA--C 1.509 -0.6 0 O-C-N 124.191 0.932 . . . . 0.0 110.897 173.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.3 p -77.61 -33.89 53.6 Favored 'General case' 0 CA--C 1.498 -1.053 0 C-N-CA 126.247 1.819 . . . . 0.0 112.374 -176.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER 69.91 -41.5 0.49 Allowed 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 128.2 2.6 . . . . 0.0 112.138 175.258 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -64.93 -26.41 68.3 Favored 'General case' 0 CA--C 1.496 -1.116 0 CA-C-O 116.066 -1.921 . . . . 0.0 110.112 175.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.457 HD13 ' CH2' ' A' ' 522' ' ' TRP . 15.8 mm -66.6 -52.87 41.15 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.093 0 O-C-N 125.494 1.746 . . . . 0.0 108.33 174.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.508 HD23 ' CE1' ' A' ' 535' ' ' PHE . 12.5 mt -52.97 -45.25 67.71 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 119.662 1.119 . . . . 0.0 111.73 -178.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.559 HD13 HD12 ' A' ' 484' ' ' LEU . 41.5 mt -71.55 -60.82 2.05 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.012 0 CA-C-O 118.128 -0.939 . . . . 0.0 111.337 177.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -48.6 -43.51 28.67 Favored Glycine 0 C--O 1.227 -0.344 0 C-N-CA 126.088 1.804 . . . . 0.0 112.841 179.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.999 HD21 HG21 ' A' ' 525' ' ' ILE . 55.1 mt -66.25 -42.4 88.63 Favored 'General case' 0 CA--C 1.5 -0.946 0 CA-C-O 116.282 -1.818 . . . . 0.0 108.525 173.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.521 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.9 tm? -65.17 -28.62 69.52 Favored 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 120.89 1.677 . . . . 0.0 111.502 176.337 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 455' ' ' ILE . 31.4 t -66.66 -55.17 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.444 0 N-CA-C 107.355 -1.35 . . . . 0.0 107.355 -178.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -81.57 -11.52 59.12 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.015 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.793 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.1 OUTLIER -130.5 74.76 79.89 Favored Pre-proline 0 N--CA 1.447 -0.591 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -179.825 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . 0.723 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.6 Cg_endo -65.01 -18.79 63.05 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 120.979 1.119 . . . . 0.0 112.197 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -71.18 -19.71 62.37 Favored 'General case' 0 C--O 1.225 -0.217 0 O-C-N 121.261 -0.899 . . . . 0.0 111.211 176.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.793 HD12 ' HB3' ' A' ' 461' ' ' ASN . 17.2 mt -69.79 -13.58 62.35 Favored 'General case' 0 N--CA 1.461 0.075 0 CA-C-N 118.593 0.633 . . . . 0.0 111.169 177.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.58 -32.84 72.96 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 117.579 0.172 . . . . 0.0 110.965 174.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 74.3 m -79.04 -21.17 47.25 Favored 'General case' 0 CA--C 1.539 0.558 0 O-C-N 121.469 -0.769 . . . . 0.0 111.693 176.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.759 HD13 HD23 ' A' ' 464' ' ' LEU . 0.5 OUTLIER -81.75 -19.26 41.73 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 121.513 -0.742 . . . . 0.0 110.297 174.891 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 489' ' ' VAL . 2.2 p -64.31 147.57 96.93 Favored Pre-proline 0 N--CA 1.444 -0.749 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -178.261 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.581 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.2 Cg_endo -74.5 172.77 15.49 Favored 'Trans proline' 0 N--CA 1.434 -1.985 0 C-N-CA 121.492 1.461 . . . . 0.0 109.829 178.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -75.42 4.4 4.98 Favored 'Trans proline' 0 N--CA 1.45 -1.06 0 C-N-CA 124.172 3.248 . . . . 0.0 112.475 173.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.547 ' CD2' HD11 ' A' ' 482' ' ' LEU . 3.9 mp 66.21 68.58 0.44 Allowed 'General case' 0 C--N 1.348 0.537 0 C-N-CA 124.136 0.975 . . . . 0.0 109.132 177.494 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 24.9 tt0 -63.98 -70.53 0.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.92 0.866 . . . . 0.0 110.215 -178.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 6.3 m-80 -106.64 31.17 5.44 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 123.732 0.813 . . . . 0.0 109.375 179.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.605 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.2 OUTLIER -90.26 -89.15 0.16 Allowed 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 106.792 -1.558 . . . . 0.0 106.792 -177.364 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.7 t70 64.19 158.44 0.09 Allowed 'General case' 0 N--CA 1.437 -1.1 0 CA-C-O 123.417 1.58 . . . . 0.0 110.324 -178.426 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.493 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 18.1 mt-10 -81.84 -16.26 51.36 Favored 'General case' 0 C--N 1.317 -0.814 0 O-C-N 120.4 -1.438 . . . . 0.0 109.094 173.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -64.76 -19.93 66.08 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 123.095 1.426 . . . . 0.0 112.801 179.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 36.4 mttt -101.27 -26.04 13.77 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 113.977 -1.465 . . . . 0.0 111.447 178.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 9.5 mt -142.52 116.11 6.38 Favored Pre-proline 0 N--CA 1.442 -0.832 0 O-C-N 124.127 0.892 . . . . 0.0 110.213 178.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -64.1 -44.2 13.15 Favored 'Trans proline' 0 CA--C 1.542 0.908 0 C-N-CA 122.269 1.979 . . . . 0.0 109.791 -178.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -79.15 -20.91 68.81 Favored Glycine 0 C--N 1.339 0.697 0 O-C-N 120.396 -1.44 . . . . 0.0 112.117 -176.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.547 HD11 ' CD2' ' A' ' 471' ' ' LEU . 1.9 tm? -55.14 -37.2 66.65 Favored 'General case' 0 CA--C 1.519 -0.226 0 CA-C-N 118.003 0.902 . . . . 0.0 110.203 174.675 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.493 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -51.17 -47.07 50.63 Favored Glycine 0 C--O 1.221 -0.709 0 CA-C-O 118.366 -1.241 . . . . 0.0 112.33 175.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.676 HD13 HD12 ' A' ' 488' ' ' LEU . 1.2 tm? -52.06 -51.97 54.11 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 119.039 1.42 . . . . 0.0 111.639 176.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.48 ' CZ ' HD22 ' A' ' 454' ' ' LEU . 24.8 t80 -55.84 -51.9 65.9 Favored 'General case' 0 N--CA 1.463 0.183 0 C-N-CA 123.812 0.845 . . . . 0.0 110.382 175.329 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.434 HH21 ' CG ' ' A' ' 490' ' ' ASN . 0.0 OUTLIER -59.88 -46.26 89.9 Favored 'General case' 0 N--CA 1.448 -0.563 0 C-N-CA 123.178 0.591 . . . . 0.0 111.372 -177.288 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -63.2 -47.83 80.88 Favored 'General case' 0 C--N 1.324 -0.515 0 C-N-CA 127.026 2.13 . . . . 0.0 110.862 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.941 HD11 HD21 ' A' ' 516' ' ' LEU . 0.4 OUTLIER -57.06 -46.12 82.72 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.257 176.182 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.966 HG11 HG11 ' A' ' 468' ' ' VAL . 72.1 t -63.48 -41.95 94.49 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.99 0 CA-C-O 117.069 -1.443 . . . . 0.0 108.708 174.557 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . 0.434 ' CG ' HH21 ' A' ' 486' ' ' ARG . 27.1 t-20 -54.43 -43.03 71.23 Favored 'General case' 0 CA--C 1.516 -0.355 0 CA-C-N 120.95 1.704 . . . . 0.0 110.779 -177.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 17.7 m -70.13 -48.35 57.84 Favored 'General case' 0 N--CA 1.436 -1.144 0 CA-C-N 114.926 -1.034 . . . . 0.0 110.803 176.669 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.538 ' SG ' HD22 ' A' ' 498' ' ' LEU . 72.7 m -59.46 -36.07 75.28 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 118.993 0.815 . . . . 0.0 111.662 177.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.663 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.3 OUTLIER -60.73 -15.19 26.69 Favored 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 128.115 2.566 . . . . 0.0 111.583 174.369 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.3 t -95.57 -57.74 2.3 Favored 'General case' 0 N--CA 1.421 -1.889 0 CA-C-O 116.59 -1.671 . . . . 0.0 108.087 172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.448 ' CB ' HD13 ' A' ' 498' ' ' LEU . 27.7 mm100 -57.91 104.24 0.41 Allowed Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.662 1.585 . . . . 0.0 110.469 -175.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -79.24 122.68 5.28 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 123.01 2.474 . . . . 0.0 111.318 -174.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 67.3 33.15 81.59 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 118.623 -1.751 . . . . 0.0 112.71 -174.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.723 HD23 ' HB3' ' A' ' 462' ' ' PRO . 2.9 tp -64.42 148.49 50.39 Favored 'General case' 0 CA--C 1.506 -0.744 0 O-C-N 120.939 -1.33 . . . . 0.0 111.346 179.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . 0.444 ' N ' ' HG ' ' A' ' 498' ' ' LEU . 1.1 p -112.05 169.16 9.04 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 125.96 1.704 . . . . 0.0 110.135 -177.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.6 m -64.66 -35.51 81.26 Favored 'General case' 0 C--N 1.318 -0.775 0 N-CA-C 112.302 0.482 . . . . 0.0 112.302 175.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.12 -46.9 33.1 Favored Glycine 0 N--CA 1.443 -0.889 0 N-CA-C 108.189 -1.964 . . . . 0.0 108.189 174.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -50.5 -43.67 55.72 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 118.04 -0.981 . . . . 0.0 108.48 -173.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 28.5 tp -52.5 -54.89 26.5 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-N 118.63 0.65 . . . . 0.0 112.218 177.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 5.3 mp -55.87 -34.84 65.86 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 118.985 -0.531 . . . . 0.0 111.941 174.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -68.11 -44.24 76.61 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 119.467 1.03 . . . . 0.0 112.23 175.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 29.9 t60 -68.54 -13.4 62.3 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.453 1.501 . . . . 0.0 111.146 176.495 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.657 ' CD2' HG21 ' A' ' 510' ' ' THR . 37.3 m-85 -118.36 18.56 13.63 Favored 'General case' 0 N--CA 1.44 -0.972 0 C-N-CA 125.425 1.49 . . . . 0.0 108.728 178.759 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 4.3 tmt_? -58.33 -20.49 43.72 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 120.795 1.634 . . . . 0.0 112.617 -178.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -137.71 42.48 1.29 Allowed Glycine 0 N--CA 1.438 -1.172 0 C-N-CA 124.454 1.026 . . . . 0.0 111.141 -178.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.781 HG22 ' H ' ' A' ' 512' ' ' ASN . 51.3 m -105.43 139.57 39.85 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-N 118.583 1.191 . . . . 0.0 109.041 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -56.03 -20.5 17.07 Favored 'General case' 0 N--CA 1.478 0.934 0 O-C-N 119.967 -1.708 . . . . 0.0 113.237 175.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.781 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m120 -94.53 -16.91 22.89 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 125.8 1.64 . . . . 0.0 112.173 178.306 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -43.88 -37.31 2.77 Favored 'General case' 0 C--O 1.209 -1.063 0 C-N-CA 125.64 1.576 . . . . 0.0 110.589 175.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.79 -60.8 2.94 Favored 'General case' 0 N--CA 1.451 -0.375 0 C-N-CA 125.509 1.524 . . . . 0.0 110.392 176.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 51.5 m -61.93 -40.75 96.58 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 118.758 -0.639 . . . . 0.0 109.889 176.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.941 HD21 HD11 ' A' ' 488' ' ' LEU . 17.4 mt -60.7 -31.34 70.62 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 119.128 0.876 . . . . 0.0 111.171 176.951 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.06 -41.53 64.04 Favored 'General case' 0 N--CA 1.449 -0.524 0 CA-C-O 122.171 0.986 . . . . 0.0 110.987 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.54 -34.72 78.42 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 119.111 -1.036 . . . . 0.0 111.179 174.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.43 HD13 HG22 ' A' ' 455' ' ' ILE . 92.1 mt -77.19 -8.86 58.27 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 116.525 -1.702 . . . . 0.0 112.195 174.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.5 t -76.16 -67.67 0.66 Allowed 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 126.414 1.886 . . . . 0.0 109.264 179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -68.68 -2.07 8.36 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 176.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.536 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.4 t90 -49.37 136.67 15.64 Favored 'General case' 0 N--CA 1.441 -0.901 0 C-N-CA 123.02 0.528 . . . . 0.0 109.967 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -123.77 3.24 8.85 Favored 'General case' 0 C--N 1.32 -0.701 0 C-N-CA 124.887 1.275 . . . . 0.0 108.457 -174.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -53.81 -37.78 63.9 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 122.515 1.15 . . . . 0.0 112.21 179.294 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.999 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -93.29 -55.71 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 CA-C-N 113.308 -1.769 . . . . 0.0 109.027 179.421 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 45.95 40.07 6.38 Favored 'General case' 0 C--N 1.344 0.343 0 O-C-N 124.612 1.195 . . . . 0.0 110.838 -178.367 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -159.47 153.21 22.92 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 106.286 -1.746 . . . . 0.0 106.286 -173.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -108.94 -25.77 10.57 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 124.722 1.209 . . . . 0.0 111.388 174.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.1 t30 -82.43 -62.83 1.51 Allowed 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 124.042 0.937 . . . . 0.0 109.617 177.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 80.1 mt -52.39 -32.89 16.83 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.186 0 N-CA-C 107.833 -1.173 . . . . 0.0 107.833 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.748 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -49.11 -58.42 4.99 Favored 'General case' 0 C--O 1.216 -0.698 0 CA-C-O 117.637 -1.173 . . . . 0.0 110.006 175.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 11.9 tt0 -50.34 -42.52 53.12 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 120.411 1.459 . . . . 0.0 113.14 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -51.68 63.15 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-N 115.956 -0.566 . . . . 0.0 110.795 176.159 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . 0.43 HG22 HG21 ' A' ' 453' ' ' ILE . 17.0 m -61.72 -28.49 69.46 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.364 1.466 . . . . 0.0 110.031 -178.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.624 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.0 t80 -69.08 -59.75 2.82 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 126.491 1.916 . . . . 0.0 109.816 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 35.3 m -61.18 -39.81 91.54 Favored 'General case' 0 N--CA 1.44 -0.929 0 O-C-N 124.028 0.83 . . . . 0.0 109.259 178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 5.0 t70 -56.86 -45.68 82.31 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.27 0.941 . . . . 0.0 110.195 176.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 3.6 t -65.18 -49.52 69.47 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 123.671 0.788 . . . . 0.0 111.461 179.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.461 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -55.4 -43.39 75.2 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.019 -0.991 . . . . 0.0 111.053 177.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -61.06 -41.21 96.18 Favored 'General case' 0 C--N 1.351 0.652 0 CA-C-O 116.166 -1.873 . . . . 0.0 107.46 176.192 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.2 t-160 -68.73 -37.26 79.3 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 120.782 1.628 . . . . 0.0 109.569 -176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.8 ttp -62.58 -55.78 24.05 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 123.817 0.847 . . . . 0.0 110.413 176.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.697 ' HA ' HD12 ' A' ' 546' ' ' LEU . 6.3 m-85 -56.06 -45.52 79.23 Favored 'General case' 0 C--N 1.331 -0.196 0 C-N-CA 126.367 1.867 . . . . 0.0 110.893 179.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -59.05 -48.96 79.7 Favored 'General case' 0 CA--C 1.5 -0.951 0 C-N-CA 126.214 1.806 . . . . 0.0 109.087 177.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . 0.422 ' O ' ' HG ' ' A' ' 549' ' ' LEU . 3.1 t -56.28 -45.66 80.05 Favored 'General case' 0 C--O 1.215 -0.759 0 N-CA-C 107.57 -1.27 . . . . 0.0 107.57 179.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.697 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.5 mt -63.16 -46.61 86.37 Favored 'General case' 0 N--CA 1.466 0.341 0 O-C-N 120.998 -1.064 . . . . 0.0 110.495 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 28.4 mt -60.62 -37.81 82.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 119.284 -0.389 . . . . 0.0 111.826 175.587 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.74 -52.63 35.25 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 125.632 1.573 . . . . 0.0 109.613 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . 0.422 ' HG ' ' O ' ' A' ' 545' ' ' SER . 14.6 mt -56.28 -45.47 80.14 Favored 'General case' 0 C--N 1.329 -0.31 0 C-N-CA 124.309 1.044 . . . . 0.0 108.702 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 35.7 ttt85 -55.15 -54.83 38.32 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 117.288 -1.339 . . . . 0.0 110.963 175.155 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -47.4 -55.31 9.18 Favored 'General case' 0 N--CA 1.449 -0.522 0 O-C-N 125.207 1.567 . . . . 0.0 109.306 178.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -59.56 -38.52 81.34 Favored 'General case' 0 N--CA 1.442 -0.858 0 O-C-N 123.71 0.631 . . . . 0.0 109.982 -178.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -59.74 -40.17 87.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 119.05 0.841 . . . . 0.0 112.818 176.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.754 ' HB2' HD21 ' A' ' 571' ' ' LEU . 2.4 mt -66.8 -51.1 59.64 Favored 'General case' 0 N--CA 1.443 -0.8 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 177.55 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.475 HD13 HD13 ' A' ' 571' ' ' LEU . 38.4 mm -64.9 -38.68 83.38 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 CA-C-O 122.976 1.369 . . . . 0.0 110.843 -179.398 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.93 -19.42 65.93 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 119.843 -1.786 . . . . 0.0 109.949 174.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 4.3 mtt-85 -106.26 11.65 30.88 Favored 'General case' 0 CA--C 1.514 -0.406 0 C-N-CA 125.51 1.524 . . . . 0.0 110.732 173.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . 0.552 ' HB2' HD11 ' A' ' 563' ' ' LEU . 0.9 OUTLIER -98.93 -29.8 12.73 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 119.994 1.27 . . . . 0.0 110.641 177.922 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -96.72 -22.23 17.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 115.639 -0.71 . . . . 0.0 112.075 -178.049 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -96.55 -68.88 0.78 Allowed 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 123.222 1.487 . . . . 0.0 108.14 -175.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -81.42 -43.69 18.57 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.352 178.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 79.68 79.33 0.84 Allowed Glycine 0 N--CA 1.442 -0.944 0 N-CA-C 109.214 -1.554 . . . . 0.0 109.214 -173.53 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.552 HD11 ' HB2' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -44.9 157.65 0.07 Allowed 'General case' 0 CA--C 1.514 -0.42 0 C-N-CA 125.563 1.545 . . . . 0.0 110.743 172.503 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -58.16 157.95 7.61 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 119.925 -0.71 . . . . 0.0 109.597 -177.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.446 ' O ' HD23 ' A' ' 569' ' ' LEU . 1.8 m-20 -53.07 -43.23 66.56 Favored 'General case' 0 C--O 1.224 -0.264 0 C-N-CA 120.841 -0.343 . . . . 0.0 110.466 175.74 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.39 -46.74 88.9 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-O 119.024 -0.512 . . . . 0.0 111.158 177.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -60.59 -35.43 76.08 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.3 0.571 . . . . 0.0 111.478 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.507 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -65.02 -37.71 88.53 Favored 'General case' 0 C--O 1.236 0.38 0 O-C-N 121.444 -0.785 . . . . 0.0 111.648 175.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.446 HD23 ' O ' ' A' ' 565' ' ' ASN . 4.2 mm? -66.55 -41.07 89.25 Favored 'General case' 0 N--CA 1.434 -1.225 0 CA-C-O 117.454 -1.26 . . . . 0.0 109.024 176.859 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -50.91 -38.3 49.18 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 121.807 0.813 . . . . 0.0 110.966 179.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.754 HD21 ' HB2' ' A' ' 554' ' ' LEU . 2.0 mt -63.07 -46.59 86.76 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 118.002 -0.999 . . . . 0.0 112.21 176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -50.56 -50.68 52.86 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.711 1.141 . . . . 0.0 108.981 173.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -60.67 -33.89 73.5 Favored 'General case' 0 C--N 1.325 -0.486 0 C-N-CA 124.501 1.12 . . . . 0.0 110.266 -176.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -73.34 -39.79 64.93 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 125.65 1.58 . . . . 0.0 111.036 176.235 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 5.2 m-80 -56.97 -45.46 82.87 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.905 0.882 . . . . 0.0 108.869 174.561 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -66.3 -31.63 72.55 Favored 'General case' 0 C--O 1.189 -2.093 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 175.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . 0.265 0.3 OUTLIER -68.87 -23.08 64.17 Favored 'General case' 0 CA--C 1.497 -1.084 0 C-N-CA 129.72 3.208 . . . . 0.0 115.06 174.336 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.67 -25.88 12.53 Favored 'General case' 0 CA--C 1.503 -0.828 0 N-CA-C 104.202 -2.518 . . . . 0.0 104.202 -174.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -87.41 55.97 3.75 Favored 'General case' 0 N--CA 1.484 1.275 0 O-C-N 117.861 -3.024 . . . . 0.0 110.809 -179.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 2.7 mtpp 62.75 167.12 0.12 Allowed 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.718 1.207 . . . . 0.0 111.104 -177.536 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 2.3 mtpm? . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 113.886 1.069 . . . . 0.0 113.886 -177.06 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.461 0.096 0 CA-C-O 118.639 -0.695 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -171.41 168.41 6.53 Favored 'General case' 0 CA--C 1.516 -0.35 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 4.5 t -131.35 133.87 45.74 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 173.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . 0.407 ' C ' ' H ' ' A' ' 452' ' ' ARG . 10.2 t -66.52 152.1 45.92 Favored 'General case' 0 CA--C 1.531 0.221 0 O-C-N 121.285 -0.884 . . . . 0.0 108.973 174.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.9 11.92 0.13 Allowed 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.645 1.578 . . . . 0.0 111.325 173.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . 0.407 ' H ' ' C ' ' A' ' 450' ' ' THR . 2.9 ttm180 -79.62 -30.47 41.43 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-O 116.515 -1.707 . . . . 0.0 109.836 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.561 HG21 ' HB2' ' A' ' 538' ' ' SER . 18.5 mm -61.98 -42.47 94.95 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.513 0 CA-C-N 119.92 1.236 . . . . 0.0 109.458 175.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.485 ' CD2' ' HE3' ' A' ' 542' ' ' MET . 4.2 mm? -60.85 -52.75 63.75 Favored 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.644 -173.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.583 HG23 HD13 ' A' ' 488' ' ' LEU . 23.0 mt -65.5 -50.37 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.681 0 C-N-CA 124.665 1.186 . . . . 0.0 108.123 179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -53.59 -50.32 53.94 Favored Glycine 0 CA--C 1.502 -0.732 0 C-N-CA 126.074 1.797 . . . . 0.0 113.344 -176.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.785 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -69.48 -47.41 64.01 Favored 'General case' 0 C--O 1.215 -0.732 0 CA-C-N 114.291 -0.955 . . . . 0.0 109.046 179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.525 HD21 ' HB2' ' A' ' 465' ' ' ALA . 3.2 tm? -59.83 -33.22 71.47 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 176.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.431 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 2.4 t -60.27 -52.32 62.67 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 C-N-CA 126.149 1.78 . . . . 0.0 108.434 175.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 8.7 mt-30 -76.34 -23.61 54.22 Favored 'General case' 0 C--O 1.232 0.145 0 C-N-CA 122.891 0.476 . . . . 0.0 111.97 178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.449 ' HB3' HD12 ' A' ' 464' ' ' LEU . 4.0 t30 -129.76 74.0 81.04 Favored Pre-proline 0 C--N 1.324 -0.525 0 C-N-CA 124.79 1.236 . . . . 0.0 110.097 -173.712 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -61.81 -19.5 65.75 Favored 'Trans proline' 0 CA--C 1.539 0.753 0 C-N-CA 122.282 1.988 . . . . 0.0 111.701 -174.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.87 -17.12 63.94 Favored 'General case' 0 CA--C 1.553 1.096 0 C-N-CA 124.946 1.298 . . . . 0.0 111.607 173.604 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.566 HD22 ' CD2' ' A' ' 535' ' ' PHE . 19.1 mt -63.98 -13.43 46.25 Favored 'General case' 0 C--N 1.353 0.747 0 O-C-N 120.113 -1.617 . . . . 0.0 109.965 173.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.557 ' HB1' HD23 ' A' ' 493' ' ' LEU . . . -65.23 -38.99 92.12 Favored 'General case' 0 N--CA 1.436 -1.16 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 88.5 m -71.68 -18.26 62.19 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 120.001 1.273 . . . . 0.0 112.464 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.1 mt -87.93 -22.13 24.52 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.578 1.151 . . . . 0.0 112.29 173.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.696 ' CG1' HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -80.08 146.85 64.09 Favored Pre-proline 0 CA--C 1.541 0.609 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 178.189 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.469 ' O ' HD12 ' A' ' 471' ' ' LEU . 23.9 Cg_endo -75.43 174.23 13.15 Favored 'Trans proline' 0 CA--C 1.553 1.426 0 C-N-CA 122.384 2.056 . . . . 0.0 111.494 174.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . 0.433 ' HD2' ' HB2' ' A' ' 469' ' ' PRO . 45.0 Cg_endo -69.34 4.37 2.05 Favored 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 125.115 3.877 . . . . 0.0 114.113 175.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 482' ' ' LEU . 5.5 mp 71.76 55.62 0.19 Allowed 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 127.647 2.379 . . . . 0.0 112.442 177.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.86 -25.98 44.01 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 113.626 0.973 . . . . 0.0 113.626 -178.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -121.29 2.08 10.27 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 124.714 1.206 . . . . 0.0 112.212 -176.589 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.454 HD21 ' CE1' ' A' ' 543' ' ' PHE . 0.6 OUTLIER -88.38 -75.99 0.41 Allowed 'General case' 0 CA--C 1.493 -1.22 0 C-N-CA 126.008 1.723 . . . . 0.0 106.933 -173.486 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 9.9 t70 63.73 159.03 0.08 Allowed 'General case' 0 CA--C 1.542 0.66 0 O-C-N 125.452 1.72 . . . . 0.0 112.542 -175.582 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -93.77 -16.02 24.59 Favored 'General case' 0 CA--C 1.548 0.871 0 O-C-N 119.981 -1.7 . . . . 0.0 110.444 -176.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -79.69 -22.38 43.49 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 127.286 2.235 . . . . 0.0 112.383 175.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.77 -16.78 33.22 Favored 'General case' 0 C--N 1.345 0.395 0 CA-C-N 119.081 0.855 . . . . 0.0 111.664 178.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 16.0 mt -140.44 103.92 6.53 Favored Pre-proline 0 N--CA 1.45 -0.44 0 C-N-CA 123.397 0.679 . . . . 0.0 110.855 -176.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.2 Cg_endo -68.77 77.84 0.73 Allowed 'Trans proline' 0 CA--C 1.544 1.006 0 C-N-CA 124.603 3.536 . . . . 0.0 110.004 -177.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.03 -11.08 3.09 Favored Glycine 0 CA--C 1.536 1.401 0 C-N-CA 125.866 1.698 . . . . 0.0 113.409 -177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.672 HD11 HD23 ' A' ' 471' ' ' LEU . 2.0 tm? -65.09 -34.31 78.11 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.434 1.617 . . . . 0.0 109.437 173.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.31 -38.47 12.71 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 119.254 0.933 . . . . 0.0 112.875 175.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.448 HD22 HD12 ' A' ' 488' ' ' LEU . 0.5 OUTLIER -57.29 -55.05 39.74 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 117.791 0.796 . . . . 0.0 109.581 174.275 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 12.8 t80 -55.99 -47.43 77.72 Favored 'General case' 0 C--N 1.339 0.134 0 C-N-CA 123.728 0.811 . . . . 0.0 111.29 177.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.97 -49.38 73.74 Favored 'General case' 0 N--CA 1.452 -0.359 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -178.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -68.66 -38.76 80.66 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.738 1.215 . . . . 0.0 111.407 -175.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.837 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.6 -49.72 76.68 Favored 'General case' 0 CA--C 1.512 -0.506 0 C-N-CA 125.688 1.595 . . . . 0.0 110.436 175.869 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.696 HG11 ' CG1' ' A' ' 468' ' ' VAL . 69.2 t -60.47 -49.94 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.029 0 CA-C-O 117.324 -1.322 . . . . 0.0 107.467 173.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -51.93 -45.48 64.32 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 120.121 1.328 . . . . 0.0 109.784 -175.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.9 m -64.1 -49.46 72.16 Favored 'General case' 0 N--CA 1.441 -0.907 0 C-N-CA 125.095 1.358 . . . . 0.0 110.45 173.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.417 ' SG ' HD11 ' A' ' 458' ' ' LEU . 98.9 m -58.18 -36.95 73.82 Favored 'General case' 0 CA--C 1.547 0.835 0 CA-C-N 120.478 1.49 . . . . 0.0 113.216 177.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.557 HD23 ' HB1' ' A' ' 465' ' ' ALA . 0.5 OUTLIER -61.11 -21.68 63.93 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 130.044 3.338 . . . . 0.0 112.156 173.876 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.9 t -93.41 -61.72 1.51 Allowed 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 107.307 -1.368 . . . . 0.0 107.307 174.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.422 ' HB3' HD13 ' A' ' 498' ' ' LEU . 63.8 mm-40 -48.91 91.88 0.04 OUTLIER Pre-proline 0 CA--C 1.545 0.76 0 C-N-CA 128.85 2.86 . . . . 0.0 112.206 -173.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -70.66 123.85 10.18 Favored 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.336 2.024 . . . . 0.0 111.345 -173.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.07 37.72 94.92 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 110.582 -1.007 . . . . 0.0 110.582 -178.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.441 HD21 HD13 ' A' ' 503' ' ' LEU . 22.6 tp -59.37 162.28 4.89 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-O 121.786 0.803 . . . . 0.0 110.187 175.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -138.75 164.32 29.89 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 125.024 1.33 . . . . 0.0 107.555 -176.497 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 24.7 m -52.37 -46.16 66.08 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 124.934 1.294 . . . . 0.0 110.268 173.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.24 -44.16 23.49 Favored Glycine 0 CA--C 1.53 1.001 0 N-CA-C 110.374 -1.09 . . . . 0.0 110.374 -177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.83 -26.9 68.98 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 124.011 0.925 . . . . 0.0 111.142 -179.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.441 HD13 HD21 ' A' ' 498' ' ' LEU . 42.2 tp -60.6 -54.33 46.63 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 173.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -62.14 -32.72 73.35 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.711 0.805 . . . . 0.0 111.159 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -67.07 -44.31 80.41 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.574 1.15 . . . . 0.0 111.243 176.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -63.93 -18.27 64.06 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.245 1.818 . . . . 0.0 112.638 174.522 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.5 ' CD2' HD13 ' A' ' 516' ' ' LEU . 55.3 m-85 -113.13 18.57 17.87 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 127.29 2.236 . . . . 0.0 111.11 176.343 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.8 125.07 20.75 Favored 'General case' 0 CA--C 1.531 0.246 0 O-C-N 120.482 -1.386 . . . . 0.0 109.874 -176.38 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.65 37.55 61.69 Favored Glycine 0 CA--C 1.529 0.918 0 N-CA-C 111.134 -0.786 . . . . 0.0 111.134 175.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.769 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.4 m -108.44 151.48 26.0 Favored 'General case' 0 CA--C 1.533 0.322 0 N-CA-C 107.893 -1.151 . . . . 0.0 107.893 177.058 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -61.29 -24.88 66.73 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.846 1.259 . . . . 0.0 110.678 173.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.769 ' H ' HG22 ' A' ' 510' ' ' THR . 10.2 m-80 -91.97 -16.91 25.89 Favored 'General case' 0 C--O 1.227 -0.095 0 CA-C-O 116.979 -1.486 . . . . 0.0 109.909 179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -49.98 -45.79 51.9 Favored 'General case' 0 C--O 1.213 -0.855 0 CA-C-N 119.567 1.076 . . . . 0.0 108.661 177.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.47 -46.13 84.04 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 113.177 0.806 . . . . 0.0 113.177 -178.108 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 81.4 m -64.16 -47.59 79.27 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 118.504 -0.76 . . . . 0.0 109.244 174.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.837 HD21 HD11 ' A' ' 488' ' ' LEU . 82.1 mt -58.39 -41.16 84.22 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.698 1.599 . . . . 0.0 110.79 179.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -69.85 -41.79 74.43 Favored 'General case' 0 CA--C 1.514 -0.427 0 C-N-CA 127.155 2.182 . . . . 0.0 109.301 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.6 tttt -62.0 -41.11 97.7 Favored 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.373 -1.299 . . . . 0.0 108.533 174.358 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.402 HD13 HG22 ' A' ' 455' ' ' ILE . 92.8 mt -73.3 -16.55 61.37 Favored 'General case' 0 CA--C 1.539 0.525 0 N-CA-C 114.192 1.182 . . . . 0.0 114.192 175.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.7 t -70.4 -36.59 74.15 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 125.137 1.375 . . . . 0.0 109.6 176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.39 2.74 31.56 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 126.108 1.763 . . . . 0.0 113.406 178.957 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.42 ' CE3' HD11 ' A' ' 525' ' ' ILE . 14.3 t90 -75.7 73.56 2.67 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.75 1.22 . . . . 0.0 108.693 178.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -86.45 -13.12 47.1 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 128.243 2.617 . . . . 0.0 111.182 175.246 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -52.61 -20.06 2.77 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 128.254 2.622 . . . . 0.0 113.205 177.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.785 HD13 ' CD2' ' A' ' 457' ' ' LEU . 54.0 mt -51.81 -69.55 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.364 0 C-N-CA 128.813 2.845 . . . . 0.0 111.459 175.26 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -162.7 -94.79 0.02 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 O-C-N 124.77 1.294 . . . . 0.0 110.537 -178.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -152.84 164.56 37.62 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.5 2.72 . . . . 0.0 108.22 -176.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.29 -21.35 64.78 Favored 'General case' 0 CA--C 1.54 0.563 0 CA-C-N 120.097 1.317 . . . . 0.0 113.829 174.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -83.22 -57.42 3.27 Favored 'General case' 0 C--O 1.225 -0.218 0 C-N-CA 125.937 1.695 . . . . 0.0 108.769 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 16.3 mt -71.17 -2.07 2.53 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 125.504 1.522 . . . . 0.0 110.199 176.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.498 ' HB1' ' CD1' ' A' ' 457' ' ' LEU . . . -56.56 -64.08 0.99 Allowed 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.666 1.121 . . . . 0.0 108.258 174.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . 0.408 ' HG3' HD21 ' A' ' 464' ' ' LEU . 30.7 tt0 -55.47 -35.81 65.91 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 122.827 0.451 . . . . 0.0 111.285 -176.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.51 -51.19 59.36 Favored 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 117.346 -1.311 . . . . 0.0 110.473 176.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 52.6 m -57.96 -36.7 72.94 Favored 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.615 1.966 . . . . 0.0 110.079 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.566 ' CD2' HD22 ' A' ' 464' ' ' LEU . 73.3 t80 -62.22 -56.01 22.87 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 118.464 -0.779 . . . . 0.0 110.75 175.374 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 52.3 m -62.34 -42.52 99.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 118.089 -0.958 . . . . 0.0 108.944 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -57.42 -47.26 82.22 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 124.87 1.268 . . . . 0.0 110.201 178.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.561 ' HB2' HG21 ' A' ' 453' ' ' ILE . 8.7 t -66.68 -44.53 81.53 Favored 'General case' 0 N--CA 1.433 -1.305 0 C-N-CA 124.164 0.986 . . . . 0.0 110.919 178.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.402 ' CD1' HG23 ' A' ' 468' ' ' VAL . 1.0 OUTLIER -55.46 -51.09 68.07 Favored 'General case' 0 C--O 1.202 -1.421 0 C-N-CA 125.157 1.383 . . . . 0.0 108.935 177.934 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.2 m-20 -60.14 -43.94 95.33 Favored 'General case' 0 C--N 1.372 1.564 0 N-CA-C 107.234 -1.395 . . . . 0.0 107.234 179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -66.36 -38.52 87.77 Favored 'General case' 0 C--N 1.325 -0.493 0 O-C-N 120.046 -1.659 . . . . 0.0 111.59 -178.027 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . 0.485 ' HE3' ' CD2' ' A' ' 454' ' ' LEU . 0.5 OUTLIER -64.97 -54.91 23.06 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.48 -1.304 . . . . 0.0 107.48 179.918 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.454 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.0 m-85 -60.43 -47.39 86.31 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 125.025 1.33 . . . . 0.0 108.1 -175.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -52.23 -51.93 55.4 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 127.227 2.211 . . . . 0.0 110.377 173.608 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.1 t -51.48 -50.57 59.6 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 123.482 0.713 . . . . 0.0 111.342 173.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.443 HD13 ' HA ' ' A' ' 474' ' ' LEU . 55.8 mt -66.19 -40.96 90.8 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 124.722 1.209 . . . . 0.0 111.374 -174.498 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 40.4 mt -63.06 -38.7 92.25 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.651 1.981 . . . . 0.0 109.201 174.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.72 -49.96 54.65 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 125.488 1.515 . . . . 0.0 109.766 -177.673 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 13.6 mt -58.23 -45.96 86.77 Favored 'General case' 0 C--N 1.333 -0.151 0 C-N-CA 125.291 1.436 . . . . 0.0 109.586 175.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 17.9 tpt180 -59.96 -46.76 88.38 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 124.068 0.947 . . . . 0.0 109.648 176.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -53.84 -47.73 70.65 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.67 -50.07 73.96 Favored 'General case' 0 N--CA 1.446 -0.67 0 CA-C-O 118.45 -0.786 . . . . 0.0 109.396 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.87 -43.63 81.41 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.423 1.889 . . . . 0.0 110.605 -177.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.564 ' HB2' HD21 ' A' ' 571' ' ' LEU . 11.1 mt -59.25 -52.64 64.8 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 124.696 1.199 . . . . 0.0 109.365 173.938 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 33.4 mm -63.62 -34.94 70.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 CA-C-N 121.379 1.899 . . . . 0.0 113.1 175.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -57.64 -37.5 73.45 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.355 -0.979 . . . . 0.0 108.355 174.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.0 mtp180 -67.96 2.24 2.18 Favored 'General case' 0 CA--C 1.504 -0.82 0 C-N-CA 128.593 2.757 . . . . 0.0 112.999 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 25.8 tt0 -94.22 -54.4 3.58 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 119.809 1.186 . . . . 0.0 111.606 178.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -72.07 8.57 1.22 Allowed 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 124.855 1.262 . . . . 0.0 113.451 177.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.5 p -124.44 -67.4 0.92 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 124.11 0.964 . . . . 0.0 110.599 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -95.59 -68.06 0.82 Allowed 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 126.695 1.998 . . . . 0.0 109.181 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 140.02 132.07 2.84 Favored Glycine 0 CA--C 1.523 0.583 0 C-N-CA 126.409 1.957 . . . . 0.0 108.544 -179.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.8 mt -77.7 120.47 22.68 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 176.702 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -58.86 172.93 0.48 Allowed 'General case' 0 C--O 1.237 0.423 0 CA-C-O 122.087 0.946 . . . . 0.0 109.712 174.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -59.57 -45.99 90.22 Favored 'General case' 0 N--CA 1.446 -0.665 0 O-C-N 121.322 -0.861 . . . . 0.0 109.952 172.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.29 -46.15 67.88 Favored 'General case' 0 C--O 1.218 -0.586 0 CA-C-O 116.998 -1.477 . . . . 0.0 110.319 -179.453 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -62.63 -42.71 99.75 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-N 121.116 1.78 . . . . 0.0 110.262 -179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 16.5 ttp85 -59.48 -37.58 78.59 Favored 'General case' 0 C--N 1.343 0.306 0 O-C-N 120.897 -1.127 . . . . 0.0 110.9 176.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 39.4 mt -73.48 -39.92 64.52 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.37 -0.824 . . . . 0.0 109.512 176.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -50.47 -46.54 56.91 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 125.649 1.58 . . . . 0.0 107.832 177.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.564 HD21 ' HB2' ' A' ' 554' ' ' LEU . 3.1 mt -55.99 -45.89 78.86 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 174.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.99 -47.73 77.19 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-N 119.661 1.119 . . . . 0.0 108.144 177.091 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.0 -32.73 73.33 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 118.943 -0.551 . . . . 0.0 111.093 -178.103 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 5.4 tp -67.74 -37.91 82.81 Favored 'General case' 0 CA--C 1.544 0.718 0 CA-C-N 119.701 1.137 . . . . 0.0 110.347 174.035 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 14.8 m-80 -71.58 -31.3 66.8 Favored 'General case' 0 N--CA 1.472 0.631 0 O-C-N 120.409 -1.432 . . . . 0.0 109.801 -175.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 1.9 pp0? -73.31 -25.41 60.64 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 118.105 -0.95 . . . . 0.0 109.608 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -78.04 -35.0 50.24 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.854 1.661 . . . . 0.0 110.75 -179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 5.0 mt -79.69 -20.28 46.92 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 125.801 1.64 . . . . 0.0 111.911 176.08 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -157.4 -88.12 0.04 OUTLIER 'General case' 0 N--CA 1.454 -0.228 0 O-C-N 120.786 -1.197 . . . . 0.0 109.776 175.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -172.7 148.43 1.9 Allowed 'General case' 0 C--O 1.235 0.307 0 C-N-CA 125.069 1.347 . . . . 0.0 109.012 178.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.467 0.383 0 N-CA-C 112.597 0.591 . . . . 0.0 112.597 174.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.4 tttp . . . . . 0 CA--C 1.55 0.947 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.53 69.79 0.5 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 126.385 1.874 . . . . 0.0 109.89 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 3.8 m -140.64 130.02 23.84 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 119.41 -2.056 . . . . 0.0 107.251 177.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 2.0 t -150.07 28.92 0.74 Allowed 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 123.278 0.631 . . . . 0.0 110.499 173.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 1.5 mtt 75.68 -38.83 0.37 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 127.163 2.185 . . . . 0.0 110.604 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . 0.544 ' HD2' HD21 ' A' ' 519' ' ' LEU . 12.6 mmt85 -59.98 -30.41 69.1 Favored 'General case' 0 C--O 1.212 -0.883 0 CA-C-O 116.353 -1.784 . . . . 0.0 109.021 173.255 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.546 HD12 ' CG2' ' A' ' 534' ' ' THR . 1.5 mm -63.7 -52.98 50.51 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 CA-C-N 120.067 1.303 . . . . 0.0 108.162 174.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 12.5 mt -56.87 -52.9 63.33 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 119.571 1.078 . . . . 0.0 108.389 -175.792 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 38.7 mt -66.63 -53.5 34.71 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.006 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.082 -176.432 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -55.6 -41.37 81.67 Favored Glycine 0 N--CA 1.474 1.231 0 C-N-CA 128.19 2.805 . . . . 0.0 112.234 -178.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.3 mt -70.92 -36.03 72.51 Favored 'General case' 0 CA--C 1.509 -0.603 0 CA-C-O 118.073 -0.965 . . . . 0.0 109.399 173.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -27.97 67.13 Favored 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 120.259 1.391 . . . . 0.0 111.744 173.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.448 ' HA ' HD23 ' A' ' 503' ' ' LEU . 33.6 t -69.24 -56.39 11.97 Favored 'Isoleucine or valine' 0 C--N 1.341 0.219 0 C-N-CA 125.089 1.356 . . . . 0.0 107.908 178.454 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 55.2 mt-30 -75.9 -8.51 57.08 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.204 0.816 . . . . 0.0 113.204 178.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.488 ' HB3' HD12 ' A' ' 464' ' ' LEU . 20.4 t-20 -146.96 70.65 12.21 Favored Pre-proline 0 CA--C 1.533 0.325 0 O-C-N 121.198 -0.939 . . . . 0.0 111.706 -178.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -62.52 -17.85 60.32 Favored 'Trans proline' 0 N--CA 1.456 -0.684 0 C-N-CA 121.832 1.688 . . . . 0.0 111.446 -175.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -68.91 -22.87 64.14 Favored 'General case' 0 C--O 1.235 0.304 0 O-C-N 120.343 -1.473 . . . . 0.0 112.352 173.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.63 HD13 ' CD1' ' A' ' 535' ' ' PHE . 49.3 mt -59.84 -14.99 17.58 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-N 119.531 1.06 . . . . 0.0 109.907 173.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.467 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -65.26 -20.57 66.48 Favored 'General case' 0 N--CA 1.451 -0.404 0 O-C-N 121.743 -0.598 . . . . 0.0 112.299 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 77.4 m -83.96 -26.19 29.44 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 119.387 0.994 . . . . 0.0 110.254 173.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.551 HD12 HD23 ' A' ' 464' ' ' LEU . 28.6 mt -84.98 -14.98 45.81 Favored 'General case' 0 N--CA 1.47 0.564 0 O-C-N 121.355 -0.84 . . . . 0.0 112.275 175.297 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 489' ' ' VAL . 3.0 p -69.41 152.09 96.56 Favored Pre-proline 0 CA--C 1.549 0.919 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 178.18 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.467 ' CD ' HD11 ' A' ' 539' ' ' LEU . 18.1 Cg_endo -73.74 170.63 19.57 Favored 'Trans proline' 0 CA--C 1.553 1.44 0 C-N-CA 122.063 1.842 . . . . 0.0 111.488 173.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -74.51 2.28 6.51 Favored 'Trans proline' 0 CA--C 1.541 0.838 1 C-N-CA 125.533 4.155 . . . . 0.0 113.953 173.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.571 HD23 HH11 ' A' ' 486' ' ' ARG . 1.0 OUTLIER 71.09 65.82 0.17 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 127.92 2.488 . . . . 0.0 110.854 174.441 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -73.23 -72.98 0.23 Allowed 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 124.51 1.124 . . . . 0.0 110.206 -173.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -89.88 13.72 13.87 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 124.665 1.186 . . . . 0.0 112.397 176.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.511 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 0.3 OUTLIER -87.14 -85.52 0.17 Allowed 'General case' 0 CA--C 1.508 -0.636 0 N-CA-C 105.233 -2.136 . . . . 0.0 105.233 -173.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.0 t0 62.47 152.13 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.636 0 O-C-N 126.384 2.302 . . . . 0.0 111.944 -176.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -84.31 -18.46 36.24 Favored 'General case' 0 C--N 1.325 -0.491 0 O-C-N 118.678 -2.514 . . . . 0.0 108.896 -178.697 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 31.8 t30 -78.3 -9.03 59.07 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 125.885 1.674 . . . . 0.0 112.95 178.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -116.74 5.98 13.2 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.569 1.547 . . . . 0.0 111.186 178.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.666 HD13 ' HG ' ' A' ' 482' ' ' LEU . 0.4 OUTLIER -129.29 163.02 49.02 Favored Pre-proline 0 C--O 1.221 -0.433 0 C-N-CA 126.226 1.81 . . . . 0.0 110.193 -179.051 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -80.89 -67.81 0.02 OUTLIER 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 120.867 1.045 . . . . 0.0 112.991 -172.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -128.03 25.06 4.99 Favored Glycine 0 C--N 1.34 0.796 0 N-CA-C 107.043 -2.423 . . . . 0.0 107.043 178.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.666 ' HG ' HD13 ' A' ' 479' ' ' LEU . 1.7 tm? -62.47 -31.22 71.92 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 118.051 -0.976 . . . . 0.0 108.565 172.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.09 -38.28 6.09 Favored Glycine 0 CA--C 1.536 1.398 0 CA-C-O 118.644 -1.087 . . . . 0.0 111.696 173.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -55.55 33.33 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 120.09 1.945 . . . . 0.0 111.728 174.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.53 ' HB3' HD22 ' A' ' 482' ' ' LEU . 81.9 t80 -53.69 -54.78 33.05 Favored 'General case' 0 C--N 1.337 0.029 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.721 174.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.571 HH11 HD23 ' A' ' 471' ' ' LEU . 2.2 ttp85 -55.61 -46.18 77.38 Favored 'General case' 0 N--CA 1.455 -0.184 0 C-N-CA 123.535 0.734 . . . . 0.0 110.973 -173.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.6 tp10 -71.59 -39.01 70.81 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.837 1.255 . . . . 0.0 110.719 -175.53 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.784 HD11 HD21 ' A' ' 516' ' ' LEU . 2.5 mt -61.16 -46.28 91.16 Favored 'General case' 0 CA--C 1.498 -1.05 0 C-N-CA 123.282 0.633 . . . . 0.0 109.862 173.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.93 HG11 HG11 ' A' ' 468' ' ' VAL . 67.4 t -61.92 -47.85 91.31 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.724 0 CA-C-O 118.095 -0.955 . . . . 0.0 108.606 176.251 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -54.38 -47.23 72.91 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.616 1.566 . . . . 0.0 109.982 -177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . 0.734 HG22 HE22 ' A' ' 495' ' ' GLN . 89.5 m -63.96 -47.49 80.2 Favored 'General case' 0 CA--C 1.558 1.278 0 C-N-CA 126.07 1.748 . . . . 0.0 109.894 172.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.2 m -60.74 -36.93 80.13 Favored 'General case' 0 N--CA 1.477 0.904 0 O-C-N 119.213 -2.18 . . . . 0.0 111.923 179.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.46 -26.82 68.9 Favored 'General case' 0 N--CA 1.468 0.472 0 C-N-CA 126.939 2.096 . . . . 0.0 111.55 173.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.78 -53.67 7.24 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.579 1.552 . . . . 0.0 108.345 173.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.734 HE22 HG22 ' A' ' 491' ' ' THR . 0.4 OUTLIER -64.06 101.06 0.24 Allowed Pre-proline 0 N--CA 1.473 0.723 0 CA-C-N 119.645 1.111 . . . . 0.0 111.883 -175.044 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo -63.25 128.73 23.44 Favored 'Trans proline' 0 N--CA 1.439 -1.717 0 N-CA-C 107.329 -1.835 . . . . 0.0 107.329 -178.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.63 48.05 56.7 Favored Glycine 0 CA--C 1.518 0.277 0 C-N-CA 124.374 0.988 . . . . 0.0 113.093 178.744 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.601 HD21 HD13 ' A' ' 503' ' ' LEU . 32.6 tp -63.61 155.54 29.39 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.149 0.979 . . . . 0.0 110.272 173.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -136.0 163.65 29.8 Favored 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.568 1.947 . . . . 0.0 108.19 -174.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 86.0 m -51.34 -46.69 62.75 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.182 0.993 . . . . 0.0 110.551 173.733 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.41 -43.89 14.59 Favored Glycine 0 CA--C 1.533 1.174 0 N-CA-C 109.888 -1.285 . . . . 0.0 109.888 -176.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 43.6 tp60 -62.0 -24.2 66.9 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 123.778 0.831 . . . . 0.0 111.188 -179.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.601 HD13 HD21 ' A' ' 498' ' ' LEU . 24.1 tp -67.09 -51.22 57.04 Favored 'General case' 0 C--N 1.338 0.089 0 C-N-CA 123.876 0.87 . . . . 0.0 110.778 176.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 7.8 mt -61.18 -34.41 75.01 Favored 'General case' 0 C--N 1.332 -0.189 0 C-N-CA 122.76 0.424 . . . . 0.0 110.151 173.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.98 -39.29 90.22 Favored 'General case' 0 CA--C 1.532 0.264 0 O-C-N 121.466 -0.771 . . . . 0.0 112.318 177.523 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 82.5 t60 -65.6 -17.84 64.88 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.615 1.566 . . . . 0.0 112.577 174.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 52.8 m-85 -117.26 21.37 13.18 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 126.99 2.116 . . . . 0.0 110.776 178.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.18 131.2 50.07 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 119.952 -1.718 . . . . 0.0 109.194 -175.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 67.86 31.08 74.93 Favored Glycine 0 CA--C 1.523 0.569 0 N-CA-C 111.077 -0.809 . . . . 0.0 111.077 173.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.796 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.9 m -102.31 148.69 25.15 Favored 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -61.74 -21.66 64.72 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.797 1.239 . . . . 0.0 111.362 173.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.796 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 t-20 -92.6 -15.75 26.49 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 125.463 1.505 . . . . 0.0 111.58 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.78 -47.57 59.62 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.25 -43.77 61.59 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 124.232 1.013 . . . . 0.0 113.28 178.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 30.0 m -66.48 -48.74 68.89 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.116 0.966 . . . . 0.0 110.382 176.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.784 HD21 HD11 ' A' ' 488' ' ' LEU . 65.2 mt -57.06 -39.43 74.9 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 125.351 1.46 . . . . 0.0 111.961 174.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -75.02 -34.3 61.9 Favored 'General case' 0 N--CA 1.466 0.361 0 C-N-CA 127.296 2.238 . . . . 0.0 110.923 -177.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.81 -33.98 75.85 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 107.116 -1.438 . . . . 0.0 107.116 173.447 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.544 HD21 ' HD2' ' A' ' 452' ' ' ARG . 77.2 mt -78.83 -13.87 59.56 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 119.953 1.251 . . . . 0.0 114.353 173.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.5 t -72.86 -60.46 2.22 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.144 1.378 . . . . 0.0 108.739 173.772 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.4 ppp? -71.1 0.76 6.92 Favored 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 125.646 1.578 . . . . 0.0 113.973 178.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 1.3 t90 -65.96 111.13 3.18 Favored 'General case' 0 N--CA 1.442 -0.864 0 C-N-CA 124.257 1.023 . . . . 0.0 111.903 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.53 0.25 47.14 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.59 2.356 . . . . 0.0 110.095 -175.543 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -61.25 -18.88 60.57 Favored 'General case' 0 N--CA 1.498 1.937 0 C-N-CA 125.983 1.713 . . . . 0.0 111.759 179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.2 pt -122.19 -78.58 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 C-N-CA 131.26 3.824 . . . . 0.0 109.743 -177.446 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.3 59.95 4.11 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.151 1.78 . . . . 0.0 111.914 -177.578 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.0 t70 -153.7 170.78 20.06 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.853 0.861 . . . . 0.0 110.914 176.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.22 -32.07 4.24 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 127.55 2.34 . . . . 0.0 110.911 173.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -84.84 -55.82 3.89 Favored 'General case' 0 N--CA 1.446 -0.626 0 O-C-N 120.552 -1.343 . . . . 0.0 109.115 -177.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 63.7 mt -58.05 -27.64 32.06 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 C-N-CA 124.235 1.014 . . . . 0.0 108.56 174.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.91 -59.93 3.62 Favored 'General case' 0 C--N 1.347 0.482 0 C-N-CA 125.168 1.387 . . . . 0.0 109.978 173.521 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.28 -42.95 64.16 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 119.386 0.994 . . . . 0.0 109.75 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -48.65 66.98 Favored 'General case' 0 N--CA 1.452 -0.338 0 N-CA-C 113.701 1.001 . . . . 0.0 113.701 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . 0.546 ' CG2' HD12 ' A' ' 453' ' ' ILE . 89.3 m -61.96 -32.75 73.22 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.79 2.036 . . . . 0.0 108.298 177.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.63 ' CD1' HD13 ' A' ' 464' ' ' LEU . 53.9 t80 -64.68 -58.71 5.55 Favored 'General case' 0 CA--C 1.513 -0.463 0 C-N-CA 125.496 1.519 . . . . 0.0 109.839 178.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -60.0 -43.82 94.95 Favored 'General case' 0 CA--C 1.546 0.823 0 CA-C-O 117.829 -1.081 . . . . 0.0 109.303 176.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.3 t0 -53.45 -43.41 68.05 Favored 'General case' 0 N--CA 1.505 2.285 0 CA-C-N 120.878 1.672 . . . . 0.0 109.473 176.185 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.404 ' HB2' ' CG2' ' A' ' 453' ' ' ILE . 2.6 t -71.07 -48.23 53.82 Favored 'General case' 0 N--CA 1.416 -2.139 0 N-CA-C 113.205 0.817 . . . . 0.0 113.205 -178.66 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.467 HD11 ' CD ' ' A' ' 469' ' ' PRO . 0.7 OUTLIER -55.13 -46.61 75.64 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 176.428 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.57 -43.91 96.78 Favored 'General case' 0 C--N 1.355 0.833 0 CA-C-O 117.776 -1.107 . . . . 0.0 108.967 179.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -67.38 -38.44 84.73 Favored 'General case' 0 N--CA 1.468 0.449 0 O-C-N 120.458 -1.401 . . . . 0.0 111.285 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -54.57 38.25 Favored 'General case' 0 N--CA 1.454 -0.263 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.535 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.654 ' HA ' HD12 ' A' ' 546' ' ' LEU . 8.5 m-85 -56.39 -48.23 77.31 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 126.49 1.916 . . . . 0.0 109.783 178.167 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.19 -50.48 71.09 Favored 'General case' 0 C--O 1.223 -0.325 0 C-N-CA 127.15 2.18 . . . . 0.0 110.134 179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.0 t -50.84 -41.28 57.58 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 124.002 0.921 . . . . 0.0 111.253 175.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.654 HD12 ' HA ' ' A' ' 543' ' ' PHE . 6.8 mt -72.85 -41.66 64.55 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 120.504 -1.372 . . . . 0.0 110.596 -176.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 547' ' ' LEU . 21.9 mt -59.56 -45.07 92.89 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 106.963 -1.495 . . . . 0.0 106.963 173.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 25.4 tt0 -63.04 -50.78 69.29 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 127.008 2.123 . . . . 0.0 110.164 -179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 2.0 mt -55.71 -44.03 77.06 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 126.192 1.797 . . . . 0.0 110.08 176.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 45.8 ttt85 -57.35 -46.89 82.86 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 118.777 -0.63 . . . . 0.0 109.693 175.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -55.36 -47.18 76.15 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.661 1.184 . . . . 0.0 110.457 178.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -66.44 -39.4 88.87 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 -178.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.96 -39.81 93.41 Favored 'General case' 0 C--O 1.232 0.167 0 C-N-CA 124.987 1.315 . . . . 0.0 111.256 179.83 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.461 ' HB2' HD21 ' A' ' 571' ' ' LEU . 3.6 mt -60.56 -55.2 36.19 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 107.159 -1.422 . . . . 0.0 107.159 174.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.486 HD11 HD22 ' A' ' 571' ' ' LEU . 23.1 mm -60.68 -41.26 87.53 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 CA-C-N 121.068 1.758 . . . . 0.0 111.199 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -62.74 -15.59 53.9 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 119.985 -1.697 . . . . 0.0 113.134 175.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 68.4 mmt-85 -98.43 13.79 30.42 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 129.263 3.025 . . . . 0.0 111.028 173.093 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -104.25 -61.78 1.4 Allowed 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 120.502 1.501 . . . . 0.0 109.736 173.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 27.7 ptt180 -63.91 -7.75 9.15 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -178.156 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 79.2 p -113.01 -64.4 1.31 Allowed 'General case' 0 N--CA 1.451 -0.409 0 C-N-CA 128.065 2.546 . . . . 0.0 109.05 -173.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -93.42 -64.51 1.08 Allowed 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 127.102 2.161 . . . . 0.0 111.023 179.692 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 134.52 119.95 2.01 Favored Glycine 0 CA--C 1.529 0.961 0 N-CA-C 107.482 -2.247 . . . . 0.0 107.482 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.473 HD23 ' HA ' ' A' ' 563' ' ' LEU . 7.1 mt -78.22 131.16 37.03 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.518 -1.29 . . . . 0.0 107.518 173.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.11 171.28 5.79 Favored 'General case' 0 C--N 1.342 0.243 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 176.837 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.35 -43.89 96.4 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 118.794 -0.622 . . . . 0.0 110.594 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -65.49 -54.32 29.97 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 107.548 -1.279 . . . . 0.0 107.548 179.237 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . 0.403 ' O ' HD12 ' A' ' 571' ' ' LEU . 13.6 mm-40 -60.18 -30.53 69.41 Favored 'General case' 0 N--CA 1.44 -0.951 0 O-C-N 119.534 -1.978 . . . . 0.0 115.658 -179.82 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? -68.44 -32.97 73.37 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.641 1.176 . . . . 0.0 109.971 175.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.42 -38.17 50.21 Favored 'General case' 0 N--CA 1.445 -0.704 0 CA-C-O 117.824 -1.084 . . . . 0.0 108.72 174.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -49.91 -44.22 50.1 Favored 'General case' 0 CA--C 1.56 1.356 0 CA-C-N 119.857 1.208 . . . . 0.0 108.256 176.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.486 HD22 HD11 ' A' ' 555' ' ' ILE . 1.1 mp -57.79 -44.55 86.37 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 117.796 -1.097 . . . . 0.0 113.47 175.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -56.32 -46.8 79.7 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 120.421 1.464 . . . . 0.0 108.542 177.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -67.3 -30.33 70.15 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.52 -177.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.4 -39.86 70.87 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.494 1.518 . . . . 0.0 110.016 173.437 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.6 m-80 -65.11 -38.91 92.23 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.636 1.574 . . . . 0.0 110.887 -177.269 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -66.64 -34.35 77.68 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 117.999 -1.0 . . . . 0.0 110.11 174.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -73.89 -32.49 63.62 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 128.228 2.611 . . . . 0.0 111.497 -176.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . 0.316 0.3 OUTLIER -90.63 -24.19 20.59 Favored 'General case' 0 C--O 1.259 1.572 0 N-CA-C 105.604 -1.998 . . . . 0.0 105.604 -179.269 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 49.95 63.59 2.12 Favored 'General case' 0 C--N 1.317 -0.821 0 C-N-CA 127.982 2.513 . . . . 0.0 111.905 175.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 3.7 mmtm 71.72 -174.61 0.17 Allowed 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.869 2.068 . . . . 0.0 107.015 -173.114 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.8 tttm . . . . . 0 C--O 1.283 2.825 0 N-CA-C 119.096 2.999 . . . . 0.0 119.096 -176.411 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.444 -0.769 0 N-CA-C 115.997 1.851 . . . . 0.0 115.997 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 70.46 176.7 0.28 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 127.539 2.335 . . . . 0.0 109.342 179.481 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 60.0 m -113.51 -77.71 0.58 Allowed 'General case' 0 C--N 1.333 -0.126 0 N-CA-C 105.997 -1.853 . . . . 0.0 105.997 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 13.6 t 41.45 44.79 2.57 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.269 1.828 . . . . 0.0 112.789 175.368 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 10.1 ptt? 52.62 3.12 0.02 OUTLIER 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.629 2.772 . . . . 0.0 115.551 -173.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 65.6 mtt-85 -81.69 -48.06 12.17 Favored 'General case' 0 CA--C 1.513 -0.447 0 CA-C-O 116.363 -1.779 . . . . 0.0 110.881 -177.517 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.52 HG23 ' CD1' ' A' ' 457' ' ' LEU . 0.5 OUTLIER -57.64 -49.77 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 CA-C-N 120.081 1.309 . . . . 0.0 109.514 -177.182 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 39.7 mt -52.61 -41.97 64.16 Favored 'General case' 0 CA--C 1.531 0.214 0 CA-C-O 118.354 -0.831 . . . . 0.0 111.661 178.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 96.7 mt -73.52 -53.49 17.87 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 119.498 1.044 . . . . 0.0 112.195 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.95 -29.08 72.53 Favored Glycine 0 CA--C 1.528 0.867 0 CA-C-N 119.74 1.155 . . . . 0.0 113.737 -173.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.682 HD21 HG21 ' A' ' 525' ' ' ILE . 40.5 mt -70.91 -43.12 68.95 Favored 'General case' 0 C--O 1.224 -0.265 0 CA-C-N 118.571 1.186 . . . . 0.0 108.73 174.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -61.57 -35.19 77.1 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.488 1.515 . . . . 0.0 110.765 174.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 12.0 t -61.28 -47.05 95.25 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 O-C-N 121.29 -0.881 . . . . 0.0 110.245 174.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -83.09 -14.38 53.84 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.522 0.729 . . . . 0.0 110.822 -174.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.425 ' HB3' HD12 ' A' ' 464' ' ' LEU . 55.6 t-20 -145.09 78.6 12.33 Favored Pre-proline 0 CA--C 1.54 0.564 0 C-N-CA 126.511 1.924 . . . . 0.0 111.403 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -64.72 -20.01 64.85 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 121.019 1.146 . . . . 0.0 113.331 -177.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -63.56 -15.95 59.45 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 120.137 1.335 . . . . 0.0 111.109 174.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.425 HD12 ' HB3' ' A' ' 461' ' ' ASN . 45.3 mt -63.4 -15.76 58.52 Favored 'General case' 0 C--N 1.345 0.387 0 O-C-N 121.022 -1.048 . . . . 0.0 109.942 173.255 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.486 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -63.72 -25.22 68.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 118.932 0.787 . . . . 0.0 110.831 173.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 63.4 m -83.54 -17.4 41.95 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.199 0.999 . . . . 0.0 111.881 174.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 12.4 mt -94.34 -5.59 46.22 Favored 'General case' 0 N--CA 1.464 0.259 0 C-N-CA 124.022 0.929 . . . . 0.0 111.98 178.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 489' ' ' VAL . 7.1 p -82.95 144.81 48.39 Favored Pre-proline 0 CA--C 1.549 0.92 0 CA-C-N 120.662 1.574 . . . . 0.0 108.691 -179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.66 164.38 35.63 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.586 2.857 . . . . 0.0 111.461 177.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_endo -67.57 12.87 0.18 Allowed 'Trans proline' 0 CA--C 1.552 1.382 0 C-N-CA 124.232 3.288 . . . . 0.0 114.445 177.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . . . . . . . . 0.319 1.7 mp 80.67 8.34 1.27 Allowed 'General case' 0 C--O 1.22 -0.45 0 C-N-CA 129.207 3.003 . . . . 0.0 115.664 173.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -33.33 -55.2 0.42 Allowed 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 129.188 2.995 . . . . 0.0 115.01 -174.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.09 -5.53 21.99 Favored 'General case' 0 N--CA 1.483 1.194 0 CA-C-O 118.509 -0.758 . . . . 0.0 112.757 -177.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.446 HD21 ' CE1' ' A' ' 543' ' ' PHE . 45.6 mt -71.21 -86.29 0.03 OUTLIER 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 125.561 1.544 . . . . 0.0 110.887 -178.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . 0.276 24.2 t0 58.96 140.97 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 129.946 3.298 . . . . 0.0 111.696 -173.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -65.64 -29.91 70.55 Favored 'General case' 0 N--CA 1.447 -0.612 0 C-N-CA 126.234 1.814 . . . . 0.0 110.285 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -63.59 -24.2 67.7 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.764 1.165 . . . . 0.0 112.431 174.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 74.9 mttt -92.43 -17.23 24.86 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 120.934 1.697 . . . . 0.0 112.077 176.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.47 ' HG ' HD21 ' A' ' 546' ' ' LEU . 7.1 mt -128.32 86.32 58.18 Favored Pre-proline 0 CA--C 1.515 -0.378 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_endo -68.76 90.15 0.42 Allowed 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.057 1.838 . . . . 0.0 110.058 -174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 134.17 -16.18 4.44 Favored Glycine 0 CA--C 1.534 1.259 0 C-N-CA 126.537 2.018 . . . . 0.0 113.156 -177.581 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 479' ' ' LEU . 4.6 tp -58.19 -24.43 59.03 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-N 120.326 2.063 . . . . 0.0 110.277 173.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.6 -41.49 12.84 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 118.689 0.677 . . . . 0.0 111.875 173.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.83 -40.79 94.09 Favored 'General case' 0 N--CA 1.475 0.778 0 CA-C-N 119.148 1.474 . . . . 0.0 111.363 176.539 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -65.07 -53.03 52.01 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 124.89 1.276 . . . . 0.0 109.776 173.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -62.91 -41.56 99.49 Favored 'General case' 0 N--CA 1.452 -0.375 0 C-N-CA 123.524 0.73 . . . . 0.0 111.127 -173.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.79 -44.0 82.43 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 123.815 0.846 . . . . 0.0 109.542 177.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.602 HD11 HD21 ' A' ' 516' ' ' LEU . 3.4 mt -54.8 -51.46 65.73 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 122.966 0.506 . . . . 0.0 111.023 174.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.716 HG11 HG11 ' A' ' 468' ' ' VAL . 55.4 t -56.81 -47.65 82.47 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.416 0 C-N-CA 125.097 1.359 . . . . 0.0 109.924 175.797 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 59.1 t30 -55.46 -45.08 76.92 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 125.473 1.509 . . . . 0.0 110.079 179.244 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 39.3 m -65.41 -40.19 93.07 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.791 1.636 . . . . 0.0 111.263 174.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.8 m -64.85 -44.27 90.3 Favored 'General case' 0 C--O 1.224 -0.245 0 CA-C-N 120.022 1.283 . . . . 0.0 110.397 178.23 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.24 -20.67 59.88 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.097 1.359 . . . . 0.0 112.815 175.5 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 16.8 t -93.43 -37.42 11.97 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 126.381 1.872 . . . . 0.0 111.367 179.054 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 57.6 mm-40 -76.76 105.79 2.75 Favored Pre-proline 0 CA--C 1.537 0.465 0 C-N-CA 124.95 1.3 . . . . 0.0 110.065 -175.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 82.5 Cg_endo -73.64 115.05 4.2 Favored 'Trans proline' 0 N--CA 1.449 -1.127 0 C-N-CA 121.792 1.661 . . . . 0.0 110.94 -173.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.54 36.92 47.75 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 111.993 -0.443 . . . . 0.0 111.993 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 19.8 tp -58.38 155.47 11.81 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 124.006 0.922 . . . . 0.0 110.542 177.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 10.8 p -139.87 174.09 10.87 Favored 'General case' 0 C--N 1.329 -0.307 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 9.2 m -55.95 -50.04 71.85 Favored 'General case' 0 C--N 1.329 -0.293 0 C-N-CA 123.644 0.777 . . . . 0.0 109.859 174.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.08 -43.57 47.95 Favored Glycine 0 CA--C 1.529 0.957 0 N-CA-C 109.712 -1.355 . . . . 0.0 109.712 -174.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.2 tp-100 -66.34 -24.52 66.53 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 124.347 1.059 . . . . 0.0 110.585 -176.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 41.6 tp -63.47 -52.47 61.24 Favored 'General case' 0 N--CA 1.456 -0.132 0 CA-C-N 119.609 1.095 . . . . 0.0 109.035 173.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.9 mp -61.83 -38.77 89.44 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 118.551 -0.738 . . . . 0.0 109.919 179.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 4.5 tp10 -62.66 -40.98 98.77 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 123.404 0.682 . . . . 0.0 110.709 177.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 79.8 t60 -69.59 -20.49 63.64 Favored 'General case' 0 N--CA 1.469 0.476 0 O-C-N 121.152 -0.968 . . . . 0.0 112.713 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 59.8 m-85 -106.61 14.36 27.09 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 124.392 1.077 . . . . 0.0 109.004 175.086 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -58.59 119.93 7.94 Favored 'General case' 0 CA--C 1.528 0.118 0 O-C-N 119.801 -1.812 . . . . 0.0 111.41 -174.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.9 15.98 66.35 Favored Glycine 0 CA--C 1.527 0.783 0 CA-C-O 119.176 -0.791 . . . . 0.0 113.012 177.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.842 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.3 m -98.17 153.07 18.72 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 104.896 -2.261 . . . . 0.0 104.896 -173.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -60.19 -20.35 58.23 Favored 'General case' 0 N--CA 1.478 0.936 0 O-C-N 121.225 -0.922 . . . . 0.0 112.039 178.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.842 ' H ' HG22 ' A' ' 510' ' ' THR . 76.5 m-20 -89.83 -19.31 24.81 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.128 1.771 . . . . 0.0 110.519 179.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.61 -51.13 58.09 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 124.473 1.109 . . . . 0.0 110.213 -177.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.92 -44.18 60.08 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.942 0.897 . . . . 0.0 112.321 179.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 53.0 m -62.24 -50.41 71.84 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 118.401 -0.809 . . . . 0.0 110.884 174.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.602 HD21 HD11 ' A' ' 488' ' ' LEU . 21.9 mt -60.09 -39.15 85.12 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.555 1.07 . . . . 0.0 111.534 178.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 19.6 tt0 -61.94 -45.79 92.14 Favored 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 126.807 2.043 . . . . 0.0 109.381 178.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 2.9 ttpt -61.42 -29.86 70.2 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 118.316 -0.849 . . . . 0.0 111.335 173.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 73.8 mt -88.41 -6.37 57.71 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.782 1.233 . . . . 0.0 112.168 176.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 7.9 t -83.24 -50.29 8.56 Favored 'General case' 0 C--O 1.223 -0.323 0 C-N-CA 126.46 1.904 . . . . 0.0 109.081 176.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.92 9.37 6.56 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.879 1.271 . . . . 0.0 113.1 179.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -76.58 78.23 3.26 Favored 'General case' 0 N--CA 1.445 -0.706 0 C-N-CA 125.942 1.697 . . . . 0.0 113.448 -172.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -57.55 -0.78 0.07 Allowed 'General case' 0 CA--C 1.534 0.33 1 C-N-CA 131.797 4.039 . . . . 0.0 113.526 174.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -54.7 -26.92 36.76 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 127.044 2.138 . . . . 0.0 111.49 174.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.682 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -112.73 -50.69 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.365 0 C-N-CA 125.84 1.656 . . . . 0.0 110.72 175.1 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 42.97 47.19 4.9 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 126.571 1.948 . . . . 0.0 113.306 179.602 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -154.0 173.01 16.57 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 174.345 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 4.9 mmmt -131.28 -19.96 2.74 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 127.19 2.196 . . . . 0.0 111.809 177.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -85.88 -56.13 3.63 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.211 2.204 . . . . 0.0 106.902 173.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 65.2 mt -59.06 -28.33 38.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 123.087 0.555 . . . . 0.0 109.75 177.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -54.11 -40.15 67.04 Favored 'General case' 0 C--O 1.223 -0.326 0 C-N-CA 124.564 1.145 . . . . 0.0 111.937 176.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.05 -49.97 65.78 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 119.362 0.983 . . . . 0.0 109.588 -178.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -62.31 -46.57 88.13 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 122.768 0.427 . . . . 0.0 110.448 -178.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 24.7 m -66.29 -30.64 71.11 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 124.604 1.161 . . . . 0.0 110.253 -178.439 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 57.3 t80 -69.7 -46.14 66.66 Favored 'General case' 0 C--O 1.224 -0.264 0 CA-C-N 119.632 1.106 . . . . 0.0 108.985 175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 56.7 m -61.25 -41.08 96.28 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 118.273 0.488 . . . . 0.0 110.315 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -60.6 -47.46 86.1 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.997 0.919 . . . . 0.0 111.074 174.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 20.5 t -63.7 -44.9 92.28 Favored 'General case' 0 N--CA 1.464 0.239 0 O-C-N 121.156 -0.965 . . . . 0.0 111.963 178.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.02 -50.92 69.56 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-O 118.44 -0.79 . . . . 0.0 109.74 175.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -54.77 -44.52 73.77 Favored 'General case' 0 C--O 1.217 -0.607 0 CA-C-O 118.175 -0.917 . . . . 0.0 109.12 174.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 8.8 t60 -66.7 -35.57 80.46 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 119.868 1.213 . . . . 0.0 111.044 -176.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.09 -49.12 71.28 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 174.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.446 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.3 m-85 -64.18 -47.09 81.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.687 0.676 . . . . 0.0 111.303 -178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -53.75 -49.05 69.05 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 128.419 2.687 . . . . 0.0 108.53 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 23.2 t -58.68 -42.66 89.02 Favored 'General case' 0 C--N 1.341 0.238 0 O-C-N 121.708 -0.62 . . . . 0.0 111.48 176.254 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.47 HD21 ' HG ' ' A' ' 479' ' ' LEU . 60.2 mt -71.61 -32.33 67.89 Favored 'General case' 0 CA--C 1.516 -0.335 0 CA-C-N 119.165 0.893 . . . . 0.0 110.155 -175.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 21.7 mt -70.85 -41.05 71.98 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.618 0.767 . . . . 0.0 109.118 177.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 4.9 tt0 -62.29 -50.58 71.12 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 124.002 0.921 . . . . 0.0 109.184 175.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 51.7 mt -57.83 -39.06 76.75 Favored 'General case' 0 CA--C 1.532 0.278 0 C-N-CA 124.206 1.003 . . . . 0.0 110.448 174.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 10.7 ttm-85 -61.84 -42.94 99.66 Favored 'General case' 0 C--N 1.343 0.312 0 CA-C-O 118.103 -0.951 . . . . 0.0 108.771 176.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -61.61 -41.34 97.33 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-O 116.108 -1.901 . . . . 0.0 110.368 174.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -62.37 -46.0 90.63 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-N 122.177 2.262 . . . . 0.0 109.811 176.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 tp10 -63.17 -39.09 93.64 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 -174.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 6.9 mt -68.58 -51.46 42.33 Favored 'General case' 0 N--CA 1.465 0.325 0 C-N-CA 124.956 1.302 . . . . 0.0 111.388 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 44.8 mm -64.16 -36.62 77.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 119.536 1.062 . . . . 0.0 109.123 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.45 -33.61 75.94 Favored 'General case' 0 C--O 1.234 0.269 0 O-C-N 120.335 -1.478 . . . . 0.0 111.48 173.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 52.0 mtt-85 -61.14 -32.43 72.13 Favored 'General case' 0 CA--C 1.514 -0.411 0 CA-C-O 116.331 -1.795 . . . . 0.0 109.323 173.912 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -57.22 -42.29 81.08 Favored 'General case' 0 N--CA 1.47 0.551 0 CA-C-N 121.402 1.91 . . . . 0.0 110.527 176.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.94 3.65 7.9 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -177.187 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.497 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.92 -85.89 0.09 Allowed 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 119.417 1.008 . . . . 0.0 108.934 -179.365 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.497 ' H ' HG23 ' A' ' 560' ' ' THR . 3.2 m-70 -47.4 -41.32 19.71 Favored 'General case' 0 C--N 1.324 -0.501 0 C-N-CA 126.994 2.118 . . . . 0.0 113.558 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 90.8 101.16 1.21 Allowed Glycine 0 CA--C 1.526 0.728 0 N-CA-C 109.579 -1.409 . . . . 0.0 109.579 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 16.8 mt -59.15 132.61 54.54 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 173.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.14 170.58 13.67 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-O 122.918 1.342 . . . . 0.0 109.249 176.225 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.52 -40.02 94.86 Favored 'General case' 0 CA--C 1.518 -0.276 0 CA-C-N 115.062 -0.972 . . . . 0.0 108.804 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -71.29 -46.63 60.38 Favored 'General case' 0 N--CA 1.452 -0.368 0 O-C-N 125.706 1.879 . . . . 0.0 109.124 -179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -65.39 -35.27 80.44 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 119.517 1.053 . . . . 0.0 111.598 -174.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.4 ' HA ' HD12 ' A' ' 571' ' ' LEU . 9.7 ttm180 -63.01 -31.75 72.96 Favored 'General case' 0 CA--C 1.537 0.481 0 O-C-N 120.595 -1.315 . . . . 0.0 109.472 174.611 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 5.0 mp -78.23 -32.3 49.71 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-O 117.885 -1.055 . . . . 0.0 110.458 173.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.5 tt0 -57.49 -43.38 84.12 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 120.699 1.59 . . . . 0.0 107.671 173.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.4 HD12 ' HA ' ' A' ' 568' ' ' ARG . 3.4 mt -58.22 -39.84 80.08 Favored 'General case' 0 C--O 1.225 -0.187 0 CA-C-O 116.481 -1.723 . . . . 0.0 113.269 175.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.3 OUTLIER -62.38 -40.68 97.26 Favored 'General case' 0 C--N 1.345 0.413 0 CA-C-N 122.383 2.356 . . . . 0.0 109.095 178.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -69.29 -41.63 76.55 Favored 'General case' 0 N--CA 1.442 -0.828 0 N-CA-C 107.96 -1.126 . . . . 0.0 107.96 -177.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -59.8 -40.21 87.6 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 120.595 -1.315 . . . . 0.0 110.77 174.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 16.2 m-80 -57.93 -42.98 86.0 Favored 'General case' 0 C--N 1.34 0.177 0 C-N-CA 124.758 1.223 . . . . 0.0 110.331 174.031 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -77.43 -27.8 52.36 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 120.295 1.407 . . . . 0.0 111.375 -176.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -67.47 -42.29 83.22 Favored 'General case' 0 C--O 1.238 0.471 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 174.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 22.8 mt -78.81 -23.8 44.91 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 118.7 0.682 . . . . 0.0 110.887 -178.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -59.51 -29.85 68.16 Favored 'General case' 0 CA--C 1.533 0.305 0 O-C-N 121.744 -0.597 . . . . 0.0 111.948 -178.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp 49.43 -71.95 0.0 OUTLIER 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 129.771 3.228 . . . . 0.0 114.16 173.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.6 ttmt . . . . . 0 CA--C 1.533 0.322 0 O-C-N 119.965 -1.71 . . . . 0.0 106.754 173.813 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 9.3 tptt . . . . . 0 C--O 1.236 0.375 0 N-CA-C 107.178 -1.416 . . . . 0.0 107.178 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -178.39 158.51 1.12 Allowed 'General case' 0 CA--C 1.505 -0.778 0 N-CA-C 106.833 -1.543 . . . . 0.0 106.833 -173.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . 0.767 HG21 ' HA ' ' A' ' 538' ' ' SER . 10.8 t -163.79 158.53 20.23 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 107.368 -1.345 . . . . 0.0 107.368 173.811 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -130.52 164.03 25.76 Favored 'General case' 0 C--N 1.328 -0.332 0 C-N-CA 125.782 1.633 . . . . 0.0 107.372 -174.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 17.5 ptt? -52.65 -19.02 2.07 Favored 'General case' 0 CA--C 1.539 0.557 0 N-CA-C 112.954 0.724 . . . . 0.0 112.954 174.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 2.7 mmm-85 -59.75 -39.68 85.58 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-O 118.179 -0.915 . . . . 0.0 109.61 177.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 22.4 mm -67.98 -43.83 85.33 Favored 'Isoleucine or valine' 0 C--N 1.362 1.147 0 CA-C-O 115.146 -2.359 . . . . 0.0 108.873 176.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.631 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 2.9 mm? -59.05 -54.51 46.25 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.47 1.941 . . . . 0.0 108.694 -177.842 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.436 HG23 HD13 ' A' ' 488' ' ' LEU . 25.6 mt -59.97 -59.63 3.74 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.689 0 C-N-CA 124.266 1.026 . . . . 0.0 111.098 177.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.36 -29.32 71.17 Favored Glycine 0 N--CA 1.468 0.787 0 CA-C-N 120.847 1.658 . . . . 0.0 113.551 -173.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.589 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.1 OUTLIER -71.34 -45.89 61.87 Favored 'General case' 0 C--O 1.22 -0.456 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.457 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -63.44 -32.12 73.47 Favored 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 127.415 2.286 . . . . 0.0 110.83 175.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.44 HG22 HD21 ' A' ' 503' ' ' LEU . 18.6 t -66.67 -55.08 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 C-N-CA 124.654 1.182 . . . . 0.0 108.201 174.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 500' ' ' THR . 76.5 mt-30 -72.2 -17.73 61.91 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-O 118.707 -0.663 . . . . 0.0 112.461 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.448 ' HB3' HD12 ' A' ' 464' ' ' LEU . 53.0 t-20 -146.29 80.62 10.01 Favored Pre-proline 0 CA--C 1.539 0.548 0 C-N-CA 127.164 2.186 . . . . 0.0 110.68 -174.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo -69.6 -20.92 34.97 Favored 'Trans proline' 0 C--N 1.347 0.478 0 C-N-CA 122.207 1.938 . . . . 0.0 112.296 -174.391 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 68.7 mm-40 -66.92 -18.92 65.61 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.929 0.892 . . . . 0.0 110.039 173.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.448 HD12 ' HB3' ' A' ' 461' ' ' ASN . 43.9 mt -63.85 -12.09 33.27 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.953 1.706 . . . . 0.0 110.179 173.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.66 -37.94 87.93 Favored 'General case' 0 C--O 1.223 -0.304 0 CA-C-N 119.015 0.825 . . . . 0.0 109.818 173.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 61.3 m -69.21 -13.28 62.32 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 118.899 0.772 . . . . 0.0 111.967 174.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 6.0 mt -97.71 -15.91 20.16 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 119.403 1.002 . . . . 0.0 112.573 177.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -80.26 146.49 62.47 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 178.87 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -74.33 169.06 23.35 Favored 'Trans proline' 0 CA--C 1.54 0.778 0 C-N-CA 123.829 3.019 . . . . 0.0 112.072 174.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.7 Cg_endo -69.83 0.51 5.59 Favored 'Trans proline' 0 CA--C 1.552 1.381 0 C-N-CA 122.703 2.269 . . . . 0.0 114.819 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.879 HD22 HD11 ' A' ' 482' ' ' LEU 0.286 1.2 mp 76.04 39.92 0.28 Allowed 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 130.063 3.345 . . . . 0.0 115.816 177.225 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -67.68 -51.55 48.33 Favored 'General case' 0 CA--C 1.554 1.128 0 C-N-CA 125.299 1.44 . . . . 0.0 114.108 -178.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -78.72 2.49 19.45 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.004 -1.685 . . . . 0.0 111.732 174.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.53 HD21 ' CE1' ' A' ' 543' ' ' PHE . 5.8 mp -112.4 -74.29 0.64 Allowed 'General case' 0 N--CA 1.441 -0.897 0 C-N-CA 123.375 0.67 . . . . 0.0 111.083 -173.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 5.9 t70 60.06 169.24 0.08 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-O 123.928 1.823 . . . . 0.0 110.348 -173.078 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -84.23 -24.4 30.05 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 125.823 1.649 . . . . 0.0 108.886 176.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -56.12 -48.43 76.22 Favored 'General case' 0 C--N 1.342 0.246 0 C-N-CA 126.397 1.879 . . . . 0.0 108.609 173.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 56.2 mmtt -74.81 -32.04 61.87 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 119.012 -1.075 . . . . 0.0 111.99 -174.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.42 ' CD1' HD21 ' A' ' 546' ' ' LEU . 17.0 mt -131.09 115.92 16.61 Favored Pre-proline 0 C--O 1.225 -0.214 0 N-CA-C 108.196 -1.038 . . . . 0.0 108.196 -173.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -70.25 -51.47 0.34 Allowed 'Trans proline' 0 N--CA 1.456 -0.729 0 CA-C-N 120.67 1.275 . . . . 0.0 111.739 -174.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -67.08 -19.9 70.44 Favored Glycine 0 CA--C 1.528 0.906 0 C-N-CA 124.862 1.22 . . . . 0.0 112.207 -177.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.879 HD11 HD22 ' A' ' 471' ' ' LEU . 1.4 tm? -61.15 -33.5 73.51 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 125.567 1.547 . . . . 0.0 110.418 174.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.35 -47.86 6.9 Favored Glycine 0 CA--C 1.527 0.814 0 O-C-N 123.833 0.708 . . . . 0.0 111.844 174.501 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.731 HD11 HD21 ' A' ' 512' ' ' ASN . 0.9 OUTLIER -59.8 -41.35 91.03 Favored 'General case' 0 N--CA 1.466 0.335 0 C-N-CA 124.133 0.973 . . . . 0.0 112.315 176.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.631 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 41.2 t80 -66.81 -51.17 58.88 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 120.578 1.535 . . . . 0.0 109.777 174.328 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 ttp85 -55.63 -47.31 76.82 Favored 'General case' 0 C--O 1.22 -0.469 0 CA-C-N 118.449 0.568 . . . . 0.0 111.0 -176.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.6 tt0 -65.48 -39.99 92.59 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 123.891 0.876 . . . . 0.0 110.792 -175.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.477 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -64.06 -47.6 79.53 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 124.85 1.26 . . . . 0.0 112.484 174.472 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.705 HG11 HG11 ' A' ' 468' ' ' VAL . 49.4 t -59.0 -49.45 83.23 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.465 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 174.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -55.33 -44.11 75.59 Favored 'General case' 0 N--CA 1.463 0.219 0 C-N-CA 124.662 1.185 . . . . 0.0 108.944 -176.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 55.0 m -63.01 -43.86 97.59 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 127.671 2.389 . . . . 0.0 111.837 173.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.6 m -63.6 -44.06 95.11 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 119.251 0.932 . . . . 0.0 109.457 176.52 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.1 -16.99 64.09 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.71 1.204 . . . . 0.0 111.229 173.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -91.68 -16.44 26.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 124.753 1.221 . . . . 0.0 112.293 176.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 17.7 mt-30 -122.26 82.45 45.48 Favored Pre-proline 0 CA--C 1.536 0.427 0 C-N-CA 124.848 1.259 . . . . 0.0 107.796 175.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -63.57 139.38 69.72 Favored 'Trans proline' 0 N--CA 1.453 -0.89 0 N-CA-C 108.114 -1.533 . . . . 0.0 108.114 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 78.69 15.45 80.76 Favored Glycine 0 CA--C 1.529 0.924 0 CA-C-O 118.394 -1.225 . . . . 0.0 113.996 -175.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 5.4 tt -62.05 166.4 4.73 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 120.079 1.939 . . . . 0.0 109.183 173.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.7 p -140.93 163.01 34.12 Favored 'General case' 0 N--CA 1.47 0.559 0 O-C-N 119.569 -1.957 . . . . 0.0 108.982 -177.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.493 HG23 ' HA ' ' A' ' 460' ' ' GLN . 7.4 m -47.63 -41.72 22.68 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 125.333 1.453 . . . . 0.0 112.469 174.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -85.02 -50.38 4.14 Favored Glycine 0 CA--C 1.525 0.68 0 N-CA-C 110.034 -1.226 . . . . 0.0 110.034 -174.453 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 6.2 tp-100 -58.0 -24.19 57.18 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.007 1.723 . . . . 0.0 112.119 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.44 HD21 HG22 ' A' ' 459' ' ' VAL . 59.1 tp -58.6 -48.29 81.45 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-N 119.657 1.117 . . . . 0.0 108.865 173.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -67.46 -29.39 68.83 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 120.432 -0.507 . . . . 0.0 109.847 -178.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -67.93 -43.78 78.37 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.615 0.766 . . . . 0.0 109.991 174.385 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 81.1 t60 -60.26 -21.13 61.52 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-N 119.77 1.168 . . . . 0.0 112.868 174.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -111.53 11.84 21.32 Favored 'General case' 0 CA--C 1.529 0.136 0 C-N-CA 123.908 0.883 . . . . 0.0 110.163 178.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 34.5 ttt-85 -54.76 126.59 24.72 Favored 'General case' 0 N--CA 1.454 -0.271 0 O-C-N 120.477 -1.39 . . . . 0.0 110.832 -174.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.97 15.39 81.22 Favored Glycine 0 CA--C 1.531 1.07 0 CA-C-O 118.704 -1.053 . . . . 0.0 114.501 179.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.753 HG22 ' H ' ' A' ' 512' ' ' ASN . 75.2 m -93.1 148.23 22.18 Favored 'General case' 0 C--O 1.246 0.893 0 CA-C-N 119.222 1.511 . . . . 0.0 108.083 -179.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 14.9 p-10 -58.29 -25.34 61.7 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.172 -0.955 . . . . 0.0 111.134 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.753 ' H ' HG22 ' A' ' 510' ' ' THR . 0.6 OUTLIER -89.61 -17.94 27.5 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 127.278 2.231 . . . . 0.0 112.183 179.479 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -51.87 -49.42 62.95 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-O 119.062 -0.494 . . . . 0.0 109.917 176.221 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.36 -43.79 54.42 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 119.338 0.972 . . . . 0.0 112.567 178.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 78.9 m -60.58 -51.33 69.88 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.62 -0.881 . . . . 0.0 108.62 177.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.477 HD21 HD11 ' A' ' 488' ' ' LEU . 76.4 mt -57.13 -44.57 83.45 Favored 'General case' 0 C--O 1.219 -0.507 0 C-N-CA 125.541 1.536 . . . . 0.0 112.512 175.024 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 6.0 tt0 -66.53 -39.62 88.7 Favored 'General case' 0 N--CA 1.467 0.379 0 C-N-CA 126.641 1.976 . . . . 0.0 109.137 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.9 -37.46 84.71 Favored 'General case' 0 N--CA 1.464 0.27 0 N-CA-C 109.187 -0.671 . . . . 0.0 109.187 173.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.417 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 78.7 mt -82.72 -9.53 59.31 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 123.641 0.776 . . . . 0.0 112.315 178.475 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.8 t -76.24 -59.88 2.57 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.949 1.3 . . . . 0.0 107.583 175.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -81.35 22.58 0.67 Allowed 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 126.784 2.034 . . . . 0.0 112.777 179.719 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.5 t90 -73.03 114.71 11.49 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.436 1.643 . . . . 0.0 115.436 -173.242 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.17 7.95 43.41 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 128.413 2.685 . . . . 0.0 114.595 -173.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 15.8 t70 -70.89 -40.0 72.48 Favored 'General case' 0 N--CA 1.473 0.701 0 O-C-N 120.441 -1.412 . . . . 0.0 109.13 173.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.589 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.3 pt -108.38 -70.67 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 C-N-CA 127.361 2.264 . . . . 0.0 110.73 -174.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 49.12 37.79 11.57 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 126.76 2.024 . . . . 0.0 114.798 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -129.36 -178.74 4.79 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.739 1.216 . . . . 0.0 111.5 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -137.07 -24.68 1.1 Allowed 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 127.151 2.18 . . . . 0.0 112.301 178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -91.18 -54.79 3.79 Favored 'General case' 0 N--CA 1.446 -0.655 0 C-N-CA 127.007 2.123 . . . . 0.0 108.073 175.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 62.3 mt -62.35 -22.02 28.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 173.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -56.54 -52.75 63.59 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 120.279 1.4 . . . . 0.0 111.46 174.166 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -62.34 -42.21 99.2 Favored 'General case' 0 CA--C 1.539 0.547 0 CA-C-N 120.301 1.41 . . . . 0.0 110.68 -178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -64.01 -53.32 51.91 Favored 'General case' 0 C--N 1.34 0.184 0 O-C-N 122.025 -0.422 . . . . 0.0 111.079 -176.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 33.5 m -61.26 -33.77 74.08 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.236 -1.364 . . . . 0.0 110.664 175.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.48 ' HB2' HD12 ' A' ' 457' ' ' LEU . 41.4 t80 -64.23 -49.32 72.42 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-N 121.242 1.837 . . . . 0.0 109.786 177.296 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.3 m -62.41 -45.31 93.71 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 124.411 1.084 . . . . 0.0 111.159 178.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -61.87 -43.79 98.13 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 125.12 1.368 . . . . 0.0 110.694 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.767 ' HA ' HG21 ' A' ' 449' ' ' THR . 6.0 t -67.56 -45.9 74.27 Favored 'General case' 0 N--CA 1.438 -1.06 0 C-N-CA 124.319 1.048 . . . . 0.0 112.616 176.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.0 tt -54.92 -51.74 65.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 174.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -55.52 -44.53 76.75 Favored 'General case' 0 C--O 1.205 -1.245 0 C-N-CA 124.754 1.221 . . . . 0.0 111.327 176.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 65.8 t-80 -63.3 -38.88 92.9 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-N 119.051 0.841 . . . . 0.0 112.053 178.175 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -61.3 -51.42 68.96 Favored 'General case' 0 C--O 1.222 -0.356 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 173.889 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.537 ' HA ' HD12 ' A' ' 546' ' ' LEU . 2.5 m-85 -58.1 -48.35 80.45 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.849 0.86 . . . . 0.0 111.406 179.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -57.52 -41.44 80.86 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 126.721 2.009 . . . . 0.0 109.495 -179.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.5 t -56.73 -36.58 69.89 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 120.711 -1.243 . . . . 0.0 112.455 174.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.537 HD12 ' HA ' ' A' ' 543' ' ' PHE . 14.1 mt -81.99 -35.59 28.78 Favored 'General case' 0 CA--C 1.515 -0.366 0 C-N-CA 124.747 1.219 . . . . 0.0 109.284 -176.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -65.96 -40.81 91.61 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.218 1.407 . . . . 0.0 108.766 174.152 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -59.68 -55.68 31.31 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 125.718 1.607 . . . . 0.0 108.429 174.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 18.5 mt -52.61 -47.58 66.87 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 118.653 -0.689 . . . . 0.0 111.491 174.239 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 7.0 ttp180 -64.36 -44.07 92.57 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-N 119.86 1.209 . . . . 0.0 110.128 -179.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.2 tt0 -53.33 -49.29 67.38 Favored 'General case' 0 C--O 1.235 0.305 0 C-N-CA 124.154 0.982 . . . . 0.0 108.88 173.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -67.27 -40.68 86.18 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 118.176 0.444 . . . . 0.0 110.336 -176.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -54.78 -48.28 72.9 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.917 1.287 . . . . 0.0 108.969 177.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.412 ' HB2' HD21 ' A' ' 571' ' ' LEU . 5.1 mt -61.86 -52.73 62.92 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 125.685 1.594 . . . . 0.0 110.066 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 47.8 mm -63.69 -35.95 74.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.077 0 CA-C-N 121.88 2.127 . . . . 0.0 111.239 177.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.62 -31.88 73.19 Favored 'General case' 0 C--O 1.234 0.264 0 O-C-N 120.964 -1.085 . . . . 0.0 109.81 178.037 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 15.5 mtm180 -92.39 -3.64 54.99 Favored 'General case' 0 N--CA 1.447 -0.602 0 CA-C-O 116.724 -1.608 . . . . 0.0 111.223 173.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -76.47 -60.87 2.16 Favored 'General case' 0 N--CA 1.476 0.85 0 CA-C-N 122.718 2.508 . . . . 0.0 105.151 173.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.72 -14.52 62.84 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 115.111 1.523 . . . . 0.0 115.111 -173.342 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 62.2 p -114.01 -61.42 1.75 Allowed 'General case' 0 N--CA 1.452 -0.332 0 CA-C-N 120.81 1.641 . . . . 0.0 109.631 -176.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -82.25 -35.79 27.8 Favored 'General case' 0 N--CA 1.448 -0.569 0 C-N-CA 125.068 1.347 . . . . 0.0 113.733 -175.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 77.42 80.47 0.66 Allowed Glycine 0 C--N 1.338 0.688 0 N-CA-C 108.126 -1.99 . . . . 0.0 108.126 -173.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.53 167.1 1.54 Allowed 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 173.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 8.4 t -70.19 157.89 36.81 Favored 'General case' 0 N--CA 1.433 -1.281 0 O-C-N 120.29 -1.506 . . . . 0.0 108.949 -173.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -57.9 -38.36 75.69 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 115.813 -0.63 . . . . 0.0 110.27 -179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 26.5 mt-10 -63.31 -51.86 64.28 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 124.322 1.049 . . . . 0.0 111.094 175.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 -53.75 -40.88 66.55 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 119.534 1.061 . . . . 0.0 111.361 174.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.599 ' HA ' HD12 ' A' ' 571' ' ' LEU . 4.5 tmt_? -60.93 -39.37 89.19 Favored 'General case' 0 N--CA 1.476 0.843 0 O-C-N 120.392 -1.443 . . . . 0.0 109.981 176.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 7.7 mp -72.79 -33.96 66.61 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-O 116.937 -1.506 . . . . 0.0 110.962 175.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -51.63 -43.74 62.7 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 120.446 1.475 . . . . 0.0 108.967 174.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.599 HD12 ' HA ' ' A' ' 568' ' ' ARG . 1.6 mt -57.06 -39.22 74.49 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 174.295 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -65.72 -41.24 92.51 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 121.442 1.928 . . . . 0.0 108.157 178.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.16 -35.48 80.59 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 122.442 0.297 . . . . 0.0 111.369 177.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 13.9 tp -71.05 -41.35 70.9 Favored 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.578 -1.326 . . . . 0.0 109.99 176.404 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 9.2 m-80 -60.24 -37.64 81.01 Favored 'General case' 0 CA--C 1.531 0.225 0 O-C-N 120.992 -1.067 . . . . 0.0 111.246 178.093 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 2.1 pp0? -71.54 -32.81 68.56 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 119.594 1.088 . . . . 0.0 111.019 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -66.74 -40.69 88.42 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.08 0.952 . . . . 0.0 110.318 175.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 mt -83.51 -18.71 37.53 Favored 'General case' 0 CA--C 1.549 0.928 0 O-C-N 121.147 -0.97 . . . . 0.0 108.791 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -66.89 -29.91 69.93 Favored 'General case' 0 N--CA 1.471 0.612 0 O-C-N 119.944 -1.723 . . . . 0.0 113.345 174.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 1.9 tmmt? 14.98 92.84 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 128.807 2.843 . . . . 0.0 114.642 -176.027 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt . . . . . 0 N--CA 1.477 0.92 0 C-N-CA 126.424 1.89 . . . . 0.0 110.839 -178.589 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.226 -0.162 0 N-CA-C 107.371 -1.344 . . . . 0.0 107.371 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.49 154.74 47.77 Favored 'General case' 0 N--CA 1.443 -0.793 0 N-CA-C 105.333 -2.099 . . . . 0.0 105.333 -178.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 93.5 m -62.76 151.7 37.88 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 124.136 0.974 . . . . 0.0 109.678 174.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 5.5 t -82.16 167.06 19.1 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.852 1.261 . . . . 0.0 110.086 179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -110.37 47.02 0.99 Allowed 'General case' 0 N--CA 1.452 -0.356 0 N-CA-C 107.024 -1.472 . . . . 0.0 107.024 178.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -120.53 -42.92 2.52 Favored 'General case' 0 CA--C 1.505 -0.787 0 CA-C-O 117.937 -1.03 . . . . 0.0 110.888 176.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 4.8 mm -68.94 -52.22 36.55 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.642 0 CA-C-O 117.6 -1.19 . . . . 0.0 108.788 174.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.1 mt -54.23 -50.17 67.76 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 120.405 1.457 . . . . 0.0 110.595 -177.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.468 HG22 ' HG ' ' A' ' 519' ' ' LEU . 81.9 mt -64.58 -55.6 20.46 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 118.322 -0.847 . . . . 0.0 110.163 176.482 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -56.98 -44.1 92.88 Favored Glycine 0 CA--C 1.525 0.692 0 CA-C-N 120.045 1.293 . . . . 0.0 112.815 -174.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.675 HD21 HG21 ' A' ' 525' ' ' ILE . 50.9 mt -65.26 -50.28 66.35 Favored 'General case' 0 N--CA 1.442 -0.829 0 CA-C-O 117.864 -1.065 . . . . 0.0 110.459 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.82 -34.42 74.51 Favored 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 118.963 0.801 . . . . 0.0 111.744 177.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.5 t -58.64 -48.85 84.53 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 O-C-N 120.899 -1.125 . . . . 0.0 109.679 175.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -79.12 -17.11 55.67 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.918 -0.489 . . . . 0.0 111.685 175.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.563 ' HB3' HD12 ' A' ' 464' ' ' LEU . 24.9 t-20 -131.42 70.96 81.78 Favored Pre-proline 0 N--CA 1.448 -0.561 0 CA-C-N 119.637 1.108 . . . . 0.0 109.198 -176.24 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_endo -66.85 -18.89 53.06 Favored 'Trans proline' 0 N--CA 1.457 -0.651 0 C-N-CA 121.704 1.603 . . . . 0.0 111.576 -174.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 23.0 mt-10 -67.45 -23.0 65.47 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 123.925 0.89 . . . . 0.0 110.605 173.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.563 HD12 ' HB3' ' A' ' 461' ' ' ASN . 63.2 mt -62.12 -12.51 19.89 Favored 'General case' 0 C--N 1.349 0.567 0 O-C-N 120.867 -1.145 . . . . 0.0 110.356 173.694 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -59.7 -39.79 85.74 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 119.946 1.248 . . . . 0.0 111.673 173.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 53.6 m -77.17 -13.96 59.86 Favored 'General case' 0 CA--C 1.546 0.814 0 CA-C-N 120.163 1.347 . . . . 0.0 111.993 175.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.3 mt -90.73 -19.27 23.72 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 124.356 1.063 . . . . 0.0 112.516 174.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.72 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -81.77 149.21 63.34 Favored Pre-proline 0 CA--C 1.549 0.939 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.851 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.72 ' HD2' HG22 ' A' ' 468' ' ' VAL . 17.0 Cg_endo -69.36 173.99 9.81 Favored 'Trans proline' 0 CA--C 1.544 1.024 0 C-N-CA 124.142 3.228 . . . . 0.0 112.08 173.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -75.06 5.21 4.15 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 124.046 3.164 . . . . 0.0 114.048 175.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.904 HD23 HD21 ' A' ' 482' ' ' LEU . 7.1 mp 67.62 53.61 0.7 Allowed 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 127.954 2.502 . . . . 0.0 111.675 177.288 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 12.2 tp10 -76.51 -65.66 0.9 Allowed 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 124.95 1.3 . . . . 0.0 108.95 -178.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -68.3 -12.17 60.62 Favored 'General case' 0 C--N 1.344 0.369 0 O-C-N 120.969 -1.082 . . . . 0.0 111.775 -178.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.665 HD12 ' HG ' ' A' ' 471' ' ' LEU . 22.4 mt -82.49 -77.14 0.24 Allowed 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 107.466 -1.309 . . . . 0.0 107.466 -178.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.2 t0 65.83 150.87 0.05 Allowed 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 126.064 1.746 . . . . 0.0 111.999 -174.242 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -77.2 -10.01 59.14 Favored 'General case' 0 C--O 1.236 0.368 0 O-C-N 120.325 -1.484 . . . . 0.0 111.313 178.258 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 56.7 t30 -82.09 -37.39 26.41 Favored 'General case' 0 C--O 1.242 0.661 0 C-N-CA 124.141 0.976 . . . . 0.0 111.102 -178.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.4 mttt -85.23 -29.51 24.6 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 118.508 -0.758 . . . . 0.0 110.414 -177.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.623 HD21 HD11 ' A' ' 546' ' ' LEU . 3.6 mm? -116.16 89.44 25.6 Favored Pre-proline 0 CA--C 1.538 0.495 0 C-N-CA 124.475 1.11 . . . . 0.0 109.138 -174.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -67.9 87.04 0.37 Allowed 'Trans proline' 0 N--CA 1.456 -0.678 0 C-N-CA 124.293 3.328 . . . . 0.0 110.146 -176.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 135.09 -15.57 4.25 Favored Glycine 0 CA--C 1.53 0.976 0 C-N-CA 125.767 1.651 . . . . 0.0 112.86 -179.061 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.904 HD21 HD23 ' A' ' 471' ' ' LEU . 0.9 OUTLIER -64.05 -25.95 68.34 Favored 'General case' 0 C--O 1.215 -0.751 0 CA-C-O 116.968 -1.492 . . . . 0.0 110.962 173.827 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.99 -40.47 12.72 Favored Glycine 0 C--O 1.218 -0.866 0 CA-C-N 119.68 1.127 . . . . 0.0 111.39 174.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 35.2 tp -61.33 -43.02 99.58 Favored 'General case' 0 C--O 1.223 -0.303 0 CA-C-N 118.82 1.31 . . . . 0.0 112.504 176.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -66.34 -47.59 73.0 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 124.35 1.06 . . . . 0.0 110.527 177.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.537 ' HG3' HD22 ' A' ' 471' ' ' LEU . 65.6 ttt-85 -58.73 -51.13 71.28 Favored 'General case' 0 N--CA 1.443 -0.822 0 CA-C-O 117.59 -1.195 . . . . 0.0 108.197 -178.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -61.08 -43.31 99.08 Favored 'General case' 0 N--CA 1.449 -0.503 0 O-C-N 123.83 0.707 . . . . 0.0 110.297 -179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.434 HD13 HG23 ' A' ' 455' ' ' ILE . 0.9 OUTLIER -57.82 -49.01 78.08 Favored 'General case' 0 CA--C 1.511 -0.556 0 C-N-CA 123.56 0.744 . . . . 0.0 111.609 179.143 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.67 HG11 ' CG1' ' A' ' 468' ' ' VAL . 71.9 t -62.35 -48.19 89.53 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.783 0 CA-C-O 118.129 -0.938 . . . . 0.0 109.238 175.189 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.8 t30 -53.65 -45.76 70.33 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 125.907 1.683 . . . . 0.0 108.558 -176.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 3.0 m -66.47 -45.73 78.73 Favored 'General case' 0 N--CA 1.447 -0.614 0 C-N-CA 126.401 1.88 . . . . 0.0 110.359 173.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 87.5 m -57.88 -40.3 79.93 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 121.352 1.887 . . . . 0.0 112.065 177.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -64.7 -24.5 67.59 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.36 1.464 . . . . 0.0 111.774 174.162 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -78.53 -49.72 12.85 Favored 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 123.363 0.665 . . . . 0.0 110.172 174.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -73.84 102.45 0.62 Allowed Pre-proline 0 CA--C 1.543 0.703 0 C-N-CA 124.291 1.036 . . . . 0.0 110.584 -173.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -67.41 124.35 11.95 Favored 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.566 2.177 . . . . 0.0 109.626 -175.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 62.73 41.98 99.76 Favored Glycine 0 CA--C 1.528 0.863 0 C-N-CA 123.853 0.74 . . . . 0.0 111.379 178.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 24.9 tp -61.13 156.17 18.84 Favored 'General case' 0 C--N 1.341 0.23 0 CA-C-O 121.528 0.68 . . . . 0.0 110.083 177.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -129.57 165.42 21.75 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 108.372 -0.973 . . . . 0.0 108.372 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 27.0 m -54.52 -43.25 71.73 Favored 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.448 1.499 . . . . 0.0 110.943 176.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -78.3 -39.14 23.63 Favored Glycine 0 N--CA 1.444 -0.833 0 N-CA-C 109.353 -1.499 . . . . 0.0 109.353 -178.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 40.6 tp60 -65.42 -26.81 68.14 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 123.084 0.553 . . . . 0.0 111.849 -178.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 38.2 tp -60.12 -52.68 64.3 Favored 'General case' 0 N--CA 1.449 -0.524 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 174.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.615 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.0 mm? -65.11 -31.44 72.64 Favored 'General case' 0 N--CA 1.463 0.192 0 O-C-N 122.053 -0.404 . . . . 0.0 111.745 -179.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.52 -44.12 79.14 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.321 1.048 . . . . 0.0 110.442 175.446 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 42.3 t60 -61.16 -17.31 52.3 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 120.833 -1.167 . . . . 0.0 112.714 175.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.8 m-85 -113.73 16.29 18.57 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.785 2.034 . . . . 0.0 110.141 177.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -58.44 133.21 55.57 Favored 'General case' 0 N--CA 1.456 -0.147 0 O-C-N 119.837 -1.789 . . . . 0.0 109.149 -179.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 69.93 27.97 72.43 Favored Glycine 0 CA--C 1.528 0.851 0 O-C-N 122.038 -0.413 . . . . 0.0 112.581 173.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.774 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.6 m -108.14 145.91 33.47 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.581 -1.266 . . . . 0.0 107.581 179.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -61.72 -12.04 14.81 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 124.794 1.237 . . . . 0.0 112.062 174.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.774 ' H ' HG22 ' A' ' 510' ' ' THR . 4.8 m120 -107.55 -14.13 14.91 Favored 'General case' 0 C--N 1.372 1.555 0 N-CA-C 104.496 -2.409 . . . . 0.0 104.496 -174.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -48.82 -51.33 30.02 Favored 'General case' 0 C--O 1.202 -1.411 0 CA-C-N 120.394 1.452 . . . . 0.0 110.021 172.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.42 -43.26 54.82 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.374 1.47 . . . . 0.0 113.534 176.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 17.5 m -64.86 -54.07 36.83 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 174.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.417 HD21 HD11 ' A' ' 488' ' ' LEU . 9.6 mt -56.1 -34.2 65.8 Favored 'General case' 0 C--O 1.224 -0.282 0 C-N-CA 124.278 1.031 . . . . 0.0 111.684 -178.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.37 -39.95 92.52 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 126.417 1.887 . . . . 0.0 107.853 176.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.3 tmtm? -63.44 -29.74 70.97 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 120.126 1.33 . . . . 0.0 112.114 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.468 ' HG ' HG22 ' A' ' 455' ' ' ILE . 3.5 mm? -86.84 -41.82 13.74 Favored 'General case' 0 C--O 1.21 -0.995 0 C-N-CA 125.954 1.702 . . . . 0.0 110.874 177.014 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . 0.615 ' HB2' HD21 ' A' ' 504' ' ' LEU . 14.5 t -61.29 -49.84 75.41 Favored 'General case' 0 N--CA 1.444 -0.771 0 C-N-CA 124.508 1.123 . . . . 0.0 110.323 177.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 3.6 ppp? -71.9 -7.59 49.38 Favored 'General case' 0 N--CA 1.451 -0.403 0 C-N-CA 126.198 1.799 . . . . 0.0 112.729 175.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -72.89 131.21 41.95 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 107.652 -1.24 . . . . 0.0 107.652 -175.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.46 14.86 7.13 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.062 1.745 . . . . 0.0 109.506 -173.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -61.23 -24.99 66.76 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 126.042 1.737 . . . . 0.0 110.464 178.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.675 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -99.1 -59.45 3.27 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.597 0 C-N-CA 128.564 2.746 . . . . 0.0 109.403 175.279 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.37 30.54 1.58 Allowed 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 127.253 2.221 . . . . 0.0 112.656 -176.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -140.41 165.52 27.2 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 124.672 1.189 . . . . 0.0 108.847 -174.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 7.4 mmtm -126.52 -30.42 2.84 Favored 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 127.628 2.371 . . . . 0.0 111.142 179.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 5.7 t-20 -79.83 -57.03 3.85 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.737 1.615 . . . . 0.0 107.74 177.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 51.3 mt -59.72 -28.87 41.55 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.523 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.79 -58.85 6.55 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.869 -1.062 . . . . 0.0 109.426 173.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -55.54 -42.72 75.0 Favored 'General case' 0 C--O 1.243 0.714 0 CA-C-N 120.387 1.449 . . . . 0.0 110.777 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -63.6 -55.19 25.66 Favored 'General case' 0 C--O 1.22 -0.456 0 O-C-N 121.85 -0.532 . . . . 0.0 110.303 -178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 98.3 m -64.02 -26.9 68.77 Favored 'General case' 0 C--N 1.346 0.414 0 C-N-CA 125.258 1.423 . . . . 0.0 110.239 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.427 ' CG ' HD13 ' A' ' 464' ' ' LEU . 86.4 t80 -64.42 -59.08 4.77 Favored 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 119.582 1.083 . . . . 0.0 109.151 176.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 55.8 m -60.56 -44.92 95.63 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.478 -1.249 . . . . 0.0 109.771 176.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -60.05 -44.71 94.48 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.667 1.121 . . . . 0.0 110.777 -178.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 25.7 t -66.16 -49.81 66.11 Favored 'General case' 0 N--CA 1.47 0.525 0 C-N-CA 126.799 2.04 . . . . 0.0 110.556 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.7 tt -52.31 -53.6 42.19 Favored 'General case' 0 N--CA 1.441 -0.879 0 C-N-CA 123.839 0.856 . . . . 0.0 110.76 174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.323 1.2 m-20 -64.25 -30.92 71.95 Favored 'General case' 0 N--CA 1.418 -2.045 0 C-N-CA 118.236 -1.385 . . . . 0.0 110.436 -179.885 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -70.64 -31.56 68.54 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 120.148 1.34 . . . . 0.0 110.717 176.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -55.69 9.53 Favored 'General case' 0 C--O 1.215 -0.754 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 174.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.556 ' CD1' HD21 ' A' ' 474' ' ' LEU . 17.8 m-85 -56.39 -48.17 77.43 Favored 'General case' 0 C--N 1.347 0.463 0 C-N-CA 123.727 0.811 . . . . 0.0 109.568 -179.29 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -60.5 -46.22 90.92 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 127.269 2.228 . . . . 0.0 110.655 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 34.9 t -51.56 -45.54 63.1 Favored 'General case' 0 N--CA 1.453 -0.324 0 O-C-N 122.03 -0.419 . . . . 0.0 110.132 174.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.623 HD11 HD21 ' A' ' 479' ' ' LEU . 12.0 mt -74.0 -38.95 63.94 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-O 117.916 -1.04 . . . . 0.0 110.173 -176.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.78 -47.0 87.11 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 107.308 -1.367 . . . . 0.0 107.308 177.043 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -61.78 -50.54 71.94 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 125.328 1.451 . . . . 0.0 110.974 176.597 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 33.2 mt -61.61 -46.88 87.94 Favored 'General case' 0 C--O 1.226 -0.148 0 C-N-CA 124.296 1.038 . . . . 0.0 109.834 -178.399 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . 0.408 ' O ' HD12 ' A' ' 554' ' ' LEU . 1.5 ttm-85 -64.48 -45.84 85.63 Favored 'General case' 0 C--O 1.223 -0.32 0 C-N-CA 124.518 1.127 . . . . 0.0 109.25 177.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 5.1 tt0 -53.05 -53.31 52.13 Favored 'General case' 0 N--CA 1.454 -0.273 0 C-N-CA 124.538 1.135 . . . . 0.0 109.333 175.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.9 tt0 -58.61 -43.91 89.78 Favored 'General case' 0 C--O 1.215 -0.723 0 CA-C-O 117.445 -1.264 . . . . 0.0 110.097 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -50.14 74.59 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 124.723 1.209 . . . . 0.0 110.037 179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.743 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.6 mt -58.37 -53.33 59.53 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.073 1.349 . . . . 0.0 108.527 179.252 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.7 mm -65.02 -39.65 86.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.854 0 C-N-CA 124.344 1.058 . . . . 0.0 110.891 -178.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.01 -33.11 72.75 Favored 'General case' 0 N--CA 1.445 -0.717 0 C-N-CA 127.146 2.178 . . . . 0.0 108.258 176.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -88.36 -2.27 58.5 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-O 116.143 -1.884 . . . . 0.0 110.8 172.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -89.41 -44.81 9.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 122.757 2.526 . . . . 0.0 109.622 177.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 44.7 mtt180 -68.63 -3.34 11.54 Favored 'General case' 0 C--O 1.224 -0.278 0 O-C-N 120.603 -1.311 . . . . 0.0 114.099 179.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.645 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.6 OUTLIER -138.65 -87.98 0.23 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 119.469 1.031 . . . . 0.0 109.071 -175.376 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.645 ' H ' HG23 ' A' ' 560' ' ' THR . 8.6 m-70 -55.77 -27.58 51.61 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 126.536 1.934 . . . . 0.0 113.385 -178.411 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 61.37 83.63 0.06 OUTLIER Glycine 0 N--CA 1.44 -1.089 0 C-N-CA 126.499 1.999 . . . . 0.0 109.575 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.53 160.63 0.16 Allowed 'General case' 0 C--O 1.242 0.672 0 C-N-CA 124.073 0.949 . . . . 0.0 109.942 173.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -63.68 163.14 11.95 Favored 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 118.252 -1.379 . . . . 0.0 111.028 -176.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -55.04 -42.23 72.38 Favored 'General case' 0 C--O 1.222 -0.347 0 CA-C-N 114.88 -1.054 . . . . 0.0 109.171 177.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -63.95 -50.33 69.06 Favored 'General case' 0 C--O 1.217 -0.618 0 C-N-CA 124.806 1.242 . . . . 0.0 110.922 177.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -56.89 -38.62 73.04 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 120.174 1.352 . . . . 0.0 111.842 176.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.592 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -67.73 -38.84 84.08 Favored 'General case' 0 N--CA 1.468 0.441 0 O-C-N 120.83 -1.169 . . . . 0.0 109.748 176.544 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 17.0 mt -66.06 -37.25 85.35 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-O 118.451 -0.785 . . . . 0.0 109.999 176.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.43 -43.08 75.01 Favored 'General case' 0 C--O 1.225 -0.198 0 C-N-CA 124.708 1.203 . . . . 0.0 107.765 -179.18 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 554' ' ' LEU . 3.5 mt -58.39 -41.12 84.16 Favored 'General case' 0 CA--C 1.517 -0.319 0 C-N-CA 124.575 1.15 . . . . 0.0 113.692 174.065 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -46.87 88.92 Favored 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -58.85 -44.51 91.03 Favored 'General case' 0 N--CA 1.437 -1.088 0 O-C-N 124.675 1.235 . . . . 0.0 108.462 -179.086 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -62.85 -46.73 86.55 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 125.493 1.517 . . . . 0.0 113.131 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 10.4 m-80 -62.1 -42.44 99.22 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 125.702 1.601 . . . . 0.0 110.204 -179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 19.2 mm100 -72.43 -24.17 61.18 Favored 'General case' 0 CA--C 1.537 0.457 0 CA-C-O 117.276 -1.345 . . . . 0.0 112.065 176.35 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -75.21 -37.07 61.31 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 124.711 1.205 . . . . 0.0 108.874 173.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 10.8 mt -80.47 -13.57 59.01 Favored 'General case' 0 N--CA 1.477 0.881 0 O-C-N 120.186 -1.571 . . . . 0.0 113.093 176.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 35.43 76.62 0.05 OUTLIER 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 130.357 3.463 . . . . 0.0 111.186 175.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.86 93.83 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 125.15 1.38 . . . . 0.0 113.136 -178.113 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 4.9 ttpt . . . . . 0 N--CA 1.469 0.495 0 CA-C-O 122.746 1.26 . . . . 0.0 109.727 175.267 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.3 tttt . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 121.448 0.642 . . . . 0.0 110.041 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -128.59 160.85 31.12 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 173.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER 46.65 -144.99 0.25 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 125.069 1.347 . . . . 0.0 108.653 -174.204 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -144.71 117.74 8.85 Favored 'General case' 0 C--N 1.342 0.254 0 CA-C-N 120.902 1.683 . . . . 0.0 110.324 173.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.0 mtt -75.86 40.85 0.2 Allowed 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.438 1.495 . . . . 0.0 110.443 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -128.74 -42.08 1.45 Allowed 'General case' 0 C--O 1.219 -0.53 0 C-N-CA 126.988 2.115 . . . . 0.0 108.765 173.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.4 mm -56.85 -52.41 55.44 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.278 0 CA-C-N 119.607 1.094 . . . . 0.0 109.039 179.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 34.8 mt -53.6 -33.12 53.82 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 179.124 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 82.0 mt -79.43 -54.6 11.12 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.457 0 C-N-CA 124.069 0.948 . . . . 0.0 110.208 178.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.17 -36.97 93.19 Favored Glycine 0 CA--C 1.523 0.546 0 CA-C-N 119.635 1.107 . . . . 0.0 111.692 -174.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 95.9 mt -65.83 -48.42 71.7 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 119.034 -0.508 . . . . 0.0 109.661 174.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -59.48 -31.25 69.17 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 124.459 1.103 . . . . 0.0 111.451 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.3 t -64.78 -57.78 9.83 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 124.314 1.046 . . . . 0.0 108.852 174.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -64.35 -32.4 73.99 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.412 -0.804 . . . . 0.0 111.226 -178.09 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 41.2 t-20 -131.48 87.4 46.75 Favored Pre-proline 0 CA--C 1.537 0.454 0 C-N-CA 126.069 1.747 . . . . 0.0 109.652 -174.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -69.33 -17.99 39.24 Favored 'Trans proline' 0 N--CA 1.457 -0.634 0 C-N-CA 121.504 1.469 . . . . 0.0 113.23 179.706 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.9 mp0 -61.28 -22.51 64.92 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 120.064 1.302 . . . . 0.0 110.731 174.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.509 HD22 ' CD2' ' A' ' 535' ' ' PHE . 76.9 mt -57.05 -19.14 17.31 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.106 0.962 . . . . 0.0 112.205 174.137 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.1 -26.04 68.37 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 118.737 0.699 . . . . 0.0 112.462 174.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 85.6 m -83.9 -19.85 34.04 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.816 0.847 . . . . 0.0 111.069 174.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 9.6 mt -87.45 -14.75 39.62 Favored 'General case' 0 C--O 1.233 0.231 0 C-N-CA 123.452 0.701 . . . . 0.0 112.52 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -82.68 140.93 44.25 Favored Pre-proline 0 CA--C 1.545 0.786 0 CA-C-N 119.795 1.179 . . . . 0.0 109.749 -178.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.8 Cg_endo -62.81 164.91 17.45 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.421 2.747 . . . . 0.0 110.817 173.636 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -65.93 8.95 0.24 Allowed 'Trans proline' 0 CA--C 1.549 1.265 0 C-N-CA 124.871 3.714 . . . . 0.0 115.866 -177.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.42 HD13 HD12 ' A' ' 474' ' ' LEU . 1.0 OUTLIER 90.49 -0.13 0.22 Allowed 'General case' 0 N--CA 1.478 0.944 1 C-N-CA 132.256 4.222 . . . . 0.0 113.535 175.118 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -34.52 -58.23 0.49 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 127.611 2.364 . . . . 0.0 115.724 -173.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -98.07 2.76 49.07 Favored 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 -173.661 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.42 HD12 HD13 ' A' ' 471' ' ' LEU . 80.8 mt -85.11 -65.66 0.98 Allowed 'General case' 0 C--O 1.225 -0.232 0 CA-C-O 117.713 -1.137 . . . . 0.0 109.943 178.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 24.5 t0 57.88 118.8 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 126.446 1.898 . . . . 0.0 111.172 -173.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -58.92 -27.33 65.16 Favored 'General case' 0 CA--C 1.534 0.336 0 O-C-N 120.296 -1.502 . . . . 0.0 111.285 -178.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -68.93 -23.58 64.18 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 117.548 -1.215 . . . . 0.0 112.206 174.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.8 mttp -84.93 -20.02 31.3 Favored 'General case' 0 C--N 1.348 0.529 0 CA-C-N 121.337 1.88 . . . . 0.0 111.393 173.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 546' ' ' LEU . 1.2 mt -128.98 91.85 41.46 Favored Pre-proline 0 C--O 1.235 0.318 0 CA-C-N 119.364 0.984 . . . . 0.0 111.309 -173.235 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 59.7 Cg_endo -67.16 85.23 0.33 Allowed 'Trans proline' 0 CA--C 1.537 0.634 0 C-N-CA 124.114 3.209 . . . . 0.0 111.618 -179.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 142.03 -22.33 2.45 Favored Glycine 0 CA--C 1.524 0.634 0 C-N-CA 125.505 1.526 . . . . 0.0 112.066 -177.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -58.74 -32.09 68.91 Favored 'General case' 0 C--O 1.223 -0.339 0 CA-C-N 118.963 1.382 . . . . 0.0 110.524 176.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -53.05 -32.55 42.7 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 119.301 0.955 . . . . 0.0 113.836 177.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.481 HD21 HD21 ' A' ' 512' ' ' ASN . 1.6 tt -63.25 -44.35 95.42 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 119.584 1.692 . . . . 0.0 110.763 173.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -66.02 -39.6 90.36 Favored 'General case' 0 N--CA 1.465 0.307 0 C-N-CA 123.671 0.789 . . . . 0.0 110.333 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -48.48 76.18 Favored 'General case' 0 CA--C 1.518 -0.257 0 CA-C-N 118.499 0.59 . . . . 0.0 110.255 -178.318 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -54.94 -56.56 18.26 Favored 'General case' 0 CA--C 1.519 -0.22 0 C-N-CA 125.821 1.648 . . . . 0.0 108.186 179.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 14.0 mt -52.57 -52.85 53.07 Favored 'General case' 0 N--CA 1.442 -0.836 0 C-N-CA 125.212 1.405 . . . . 0.0 111.964 179.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.605 HG11 HG11 ' A' ' 468' ' ' VAL . 43.8 t -58.41 -42.49 84.29 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.145 0 CA-C-N 119.684 1.129 . . . . 0.0 109.931 178.442 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.58 -47.95 80.72 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 118.989 0.813 . . . . 0.0 109.818 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 94.2 m -63.0 -40.45 97.81 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 126.732 2.013 . . . . 0.0 110.51 176.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.5 m -64.64 -39.64 94.05 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 120.927 -1.108 . . . . 0.0 110.448 177.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 1.1 tp -65.76 -16.86 64.18 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 123.966 0.906 . . . . 0.0 112.19 174.023 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -88.6 -41.16 12.83 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 125.739 1.615 . . . . 0.0 112.194 178.192 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 4.8 mp0 -79.33 109.62 12.1 Favored Pre-proline 0 CA--C 1.536 0.426 0 CA-C-N 120.145 1.339 . . . . 0.0 110.1 -178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -72.75 108.96 2.68 Favored 'Trans proline' 0 N--CA 1.449 -1.138 0 C-N-CA 121.217 1.278 . . . . 0.0 109.661 -177.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.85 54.97 5.57 Favored Glycine 0 CA--C 1.528 0.898 0 C-N-CA 124.09 0.853 . . . . 0.0 111.705 -176.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 32.2 tp -64.1 165.76 8.69 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.411 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -141.93 168.31 20.06 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 176.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.4 m -49.24 -51.68 31.84 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 125.242 1.417 . . . . 0.0 110.152 174.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -79.37 -37.12 25.08 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 109.822 -1.311 . . . . 0.0 109.822 -174.615 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -63.47 -31.43 72.58 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.253 0.621 . . . . 0.0 109.995 -176.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 62.6 tp -60.48 -51.97 67.2 Favored 'General case' 0 N--CA 1.463 0.175 0 C-N-CA 124.096 0.958 . . . . 0.0 110.349 174.06 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.0 mp -59.44 -36.08 75.25 Favored 'General case' 0 N--CA 1.462 0.134 0 CA-C-O 118.965 -0.54 . . . . 0.0 109.841 178.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tt0 -70.13 -38.95 75.69 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 118.318 0.508 . . . . 0.0 110.653 178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 74.0 t60 -69.8 -21.22 63.42 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 118.663 0.665 . . . . 0.0 112.121 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -105.89 8.65 32.72 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 120.169 -1.582 . . . . 0.0 109.015 174.684 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.5 ttt180 -54.45 120.66 6.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 O-C-N 119.542 -1.974 . . . . 0.0 111.409 -174.205 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 88.89 10.2 67.08 Favored Glycine 0 CA--C 1.524 0.641 0 CA-C-O 119.207 -0.774 . . . . 0.0 113.376 175.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.82 HG22 ' H ' ' A' ' 512' ' ' ASN . 25.0 m -92.26 152.49 19.79 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.941 1.371 . . . . 0.0 108.028 -176.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 5.7 m120 -61.17 -16.25 42.57 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 121.259 -0.901 . . . . 0.0 112.448 175.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.82 ' H ' HG22 ' A' ' 510' ' ' THR . 61.7 t30 -93.93 -15.12 25.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.133 0.973 . . . . 0.0 111.103 176.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -53.75 -49.31 68.45 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 119.079 0.854 . . . . 0.0 110.461 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -50.82 -42.89 58.82 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 118.739 0.699 . . . . 0.0 112.581 178.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 90.7 m -66.29 -44.79 82.51 Favored 'General case' 0 CA--C 1.538 0.513 0 O-C-N 121.894 -0.504 . . . . 0.0 110.285 178.161 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.2 mt -64.22 -37.59 88.01 Favored 'General case' 0 C--O 1.224 -0.285 0 C-N-CA 123.425 0.69 . . . . 0.0 111.011 178.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -62.08 -49.34 76.34 Favored 'General case' 0 C--N 1.331 -0.205 0 C-N-CA 126.695 1.998 . . . . 0.0 108.531 178.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -55.06 -42.04 72.22 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.57 0.748 . . . . 0.0 110.952 174.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 87.7 mt -79.24 -13.56 59.6 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 123.476 0.71 . . . . 0.0 112.332 -178.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 5.5 t -75.5 -51.64 12.51 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.19 0.996 . . . . 0.0 108.814 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 1.3 ptm -87.45 33.26 0.69 Allowed 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 127.14 2.176 . . . . 0.0 111.135 -179.321 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.8 t90 -88.02 94.92 9.94 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 122.394 1.092 . . . . 0.0 113.269 -173.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 3.3 t0 -62.71 -7.8 5.55 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 128.175 2.59 . . . . 0.0 113.364 178.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -71.08 -13.96 62.15 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.564 1.945 . . . . 0.0 112.153 -178.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 2.5 pt -137.87 -60.36 0.38 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.571 0 C-N-CA 126.234 1.814 . . . . 0.0 110.304 -176.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 53.85 0.86 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 129.92 3.288 . . . . 0.0 117.822 174.313 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . 0.535 ' CG ' ' H ' ' A' ' 528' ' ' LYS . 28.6 t70 -108.47 -173.84 2.37 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.759 1.163 . . . . 0.0 112.795 -179.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.535 ' H ' ' CG ' ' A' ' 527' ' ' ASP . 0.0 OUTLIER -142.98 -25.84 0.6 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 128.284 2.634 . . . . 0.0 111.153 -174.017 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -82.67 -58.69 2.79 Favored 'General case' 0 C--O 1.226 -0.181 0 N-CA-C 106.67 -1.604 . . . . 0.0 106.67 173.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 56.7 mt -55.87 -33.25 34.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.407 0 C-N-CA 124.553 1.141 . . . . 0.0 108.463 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.99 -50.01 67.52 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 124.547 1.139 . . . . 0.0 112.531 -175.772 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 25.2 tt0 -63.56 -39.29 94.01 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.717 0.77 . . . . 0.0 110.17 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 31.6 tt0 -68.59 -47.1 67.63 Favored 'General case' 0 N--CA 1.45 -0.449 0 O-C-N 121.701 -0.624 . . . . 0.0 110.245 -178.747 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 77.5 m -67.24 -27.27 67.08 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.402 1.081 . . . . 0.0 112.154 175.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.509 ' CD2' HD22 ' A' ' 464' ' ' LEU . 82.6 t80 -65.03 -53.38 46.82 Favored 'General case' 0 CA--C 1.512 -0.484 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 173.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 26.0 m -55.8 -44.54 77.9 Favored 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 124.44 1.096 . . . . 0.0 109.995 177.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -65.25 -45.88 82.78 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 112.115 0.413 . . . . 0.0 112.115 -179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 22.9 t -64.89 -44.6 89.11 Favored 'General case' 0 C--N 1.32 -0.695 0 O-C-N 121.579 -0.7 . . . . 0.0 109.666 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 5.6 tt -56.51 -51.32 68.95 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 124.593 1.157 . . . . 0.0 109.776 174.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 50.4 m-20 -61.6 -44.99 95.97 Favored 'General case' 0 N--CA 1.441 -0.913 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.841 -178.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 7.3 t-160 -64.43 -29.71 70.75 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.482 1.913 . . . . 0.0 109.872 175.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -65.01 -59.91 3.63 Favored 'General case' 0 C--N 1.342 0.243 0 O-C-N 120.735 -1.228 . . . . 0.0 107.787 173.199 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -59.35 -47.94 83.51 Favored 'General case' 0 C--O 1.224 -0.251 0 C-N-CA 124.596 1.159 . . . . 0.0 110.527 -176.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -50.16 -53.95 24.2 Favored 'General case' 0 CA--C 1.519 -0.247 0 C-N-CA 128.39 2.676 . . . . 0.0 109.479 175.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 16.7 t -67.3 -36.48 81.61 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-N 117.931 0.332 . . . . 0.0 111.588 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.42 HD11 HD11 ' A' ' 479' ' ' LEU . 18.7 mt -65.93 -35.92 81.93 Favored 'General case' 0 N--CA 1.465 0.29 0 O-C-N 119.961 -1.712 . . . . 0.0 110.022 177.081 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 32.0 mt -71.65 -38.36 70.73 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.188 1.395 . . . . 0.0 110.003 177.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 10.1 tt0 -59.57 -53.98 51.83 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 128.703 2.801 . . . . 0.0 108.492 174.062 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 65.7 mt -56.73 -46.76 81.14 Favored 'General case' 0 N--CA 1.457 -0.124 0 C-N-CA 124.837 1.255 . . . . 0.0 110.223 177.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.3 ttp180 -63.72 -36.89 85.33 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-O 118.398 -0.81 . . . . 0.0 111.032 176.101 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.7 tt0 -60.22 -52.88 63.41 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 177.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -62.03 -39.06 91.01 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 118.706 0.685 . . . . 0.0 109.998 -174.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.9 mm-40 -62.04 -45.87 91.68 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 124.5 1.12 . . . . 0.0 111.014 179.748 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . 0.321 0.4 OUTLIER -76.24 -34.25 59.2 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 121.222 -0.924 . . . . 0.0 110.648 -179.838 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 12.5 mm -66.52 -34.53 70.71 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 CA-C-N 119.612 1.096 . . . . 0.0 109.241 173.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -58.0 -41.33 82.83 Favored 'General case' 0 CA--C 1.522 -0.102 0 O-C-N 120.424 -1.423 . . . . 0.0 109.892 177.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 5.3 ttp180 -68.64 -5.53 20.69 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-O 116.751 -1.595 . . . . 0.0 112.12 176.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -78.85 -50.51 11.13 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 121.206 1.821 . . . . 0.0 109.69 173.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 33.1 ttp180 -77.25 14.68 0.87 Allowed 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.915 1.286 . . . . 0.0 113.916 -172.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.521 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -143.28 -81.78 0.19 Allowed 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.454 -0.779 . . . . 0.0 109.04 176.095 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.521 ' H ' HG23 ' A' ' 560' ' ' THR . 2.3 m170 -61.53 -40.88 96.26 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 125.079 1.351 . . . . 0.0 112.615 178.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 95.96 126.64 5.11 Favored Glycine 0 CA--C 1.524 0.651 0 C-N-CA 124.979 1.276 . . . . 0.0 111.735 -176.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 17.3 mt -73.64 166.01 24.05 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 173.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 16.3 m -103.53 166.53 10.37 Favored 'General case' 0 CA--C 1.517 -0.308 0 N-CA-C 108.271 -1.011 . . . . 0.0 108.271 173.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -56.61 -36.24 69.2 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.495 -173.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 3.4 mp0 -76.46 -53.3 8.31 Favored 'General case' 0 C--N 1.327 -0.383 0 O-C-N 124.32 1.013 . . . . 0.0 109.348 -179.27 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -63.43 -26.91 68.95 Favored 'General case' 0 N--CA 1.469 0.509 0 CA-C-N 119.361 0.982 . . . . 0.0 113.199 -179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.465 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -72.85 -26.33 61.43 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 120.384 -1.447 . . . . 0.0 110.274 175.107 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -84.2 -27.16 28.21 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 125.721 1.608 . . . . 0.0 110.373 178.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -52.05 -41.58 62.42 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 107.173 -1.418 . . . . 0.0 107.173 173.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.465 HD12 ' HA ' ' A' ' 568' ' ' ARG . 4.2 mt -61.04 -37.53 82.93 Favored 'General case' 0 C--N 1.34 0.186 0 CA-C-O 117.028 -1.463 . . . . 0.0 113.806 177.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -49.68 76.89 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 121.014 1.734 . . . . 0.0 107.916 174.388 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.4 m -65.24 -44.99 86.42 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 123.615 0.572 . . . . 0.0 110.25 -175.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -56.54 -43.87 80.3 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.459 1.104 . . . . 0.0 110.65 175.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.1 m-80 -62.91 -34.24 77.01 Favored 'General case' 0 N--CA 1.464 0.262 0 O-C-N 121.523 -0.736 . . . . 0.0 110.893 176.665 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -69.38 -37.87 77.76 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 118.986 0.812 . . . . 0.0 110.392 175.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 21.7 tt0 -68.3 -32.03 71.88 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 118.263 0.483 . . . . 0.0 110.118 178.006 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 14.8 mt -79.65 -29.95 41.08 Favored 'General case' 0 N--CA 1.466 0.352 0 O-C-N 121.121 -0.987 . . . . 0.0 110.205 176.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -61.31 -9.27 4.88 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.542 1.137 . . . . 0.0 113.792 176.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -151.41 120.34 6.64 Favored 'General case' 0 C--O 1.22 -0.465 0 CA-C-N 120.225 1.375 . . . . 0.0 108.116 173.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt . . . . . 0 N--CA 1.475 0.793 0 CA-C-O 116.331 -1.795 . . . . 0.0 107.966 -173.384 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.543 0.706 0 N-CA-C 114.968 1.47 . . . . 0.0 114.968 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 69.89 174.02 0.3 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.626 1.57 . . . . 0.0 111.253 -176.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -101.4 107.34 18.64 Favored 'General case' 0 CA--C 1.517 -0.294 0 C-N-CA 125.269 1.427 . . . . 0.0 107.919 179.811 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 5.2 t -84.17 55.4 3.31 Favored 'General case' 0 N--CA 1.445 -0.687 0 O-C-N 121.494 -0.754 . . . . 0.0 110.18 177.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 4.5 tmm? 48.57 45.93 21.12 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-O 123.386 1.565 . . . . 0.0 110.903 -176.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 33.2 mtt85 -127.9 -48.55 1.36 Allowed 'General case' 0 CA--C 1.488 -1.415 0 CA-C-O 116.928 -1.511 . . . . 0.0 109.33 -179.145 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.565 HD12 ' CG2' ' A' ' 534' ' ' THR . 6.6 mm -61.15 -40.35 85.54 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.759 0 C-N-CA 118.785 -1.166 . . . . 0.0 108.791 174.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.8 mt -62.31 -52.99 61.47 Favored 'General case' 0 C--O 1.227 -0.121 0 CA-C-N 120.294 1.406 . . . . 0.0 109.907 -177.401 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.593 HG23 HD13 ' A' ' 488' ' ' LEU . 73.5 mt -70.33 -55.33 14.91 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.038 0 CA-C-O 117.787 -1.102 . . . . 0.0 110.86 -177.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -49.22 -55.71 11.93 Favored Glycine 0 N--CA 1.442 -0.903 0 N-CA-C 109.239 -1.544 . . . . 0.0 109.239 -176.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.573 ' CD2' HD13 ' A' ' 525' ' ' ILE . 0.7 OUTLIER -50.97 -46.68 61.34 Favored 'General case' 0 N--CA 1.431 -1.396 0 CA-C-O 117.175 -1.393 . . . . 0.0 113.412 174.846 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.524 HD21 ' HB2' ' A' ' 465' ' ' ALA . 2.3 tm? -61.95 -29.97 70.6 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 124.306 1.004 . . . . 0.0 111.345 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 22.2 t -67.81 -54.77 20.34 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.692 0 C-N-CA 124.446 1.099 . . . . 0.0 109.126 176.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -74.6 -11.47 60.21 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 121.778 -0.576 . . . . 0.0 112.068 177.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.737 ' HB3' HD12 ' A' ' 464' ' ' LEU . 5.3 t-20 -142.33 78.05 17.04 Favored Pre-proline 0 N--CA 1.445 -0.71 0 CA-C-N 118.513 0.597 . . . . 0.0 110.297 -178.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -65.57 -20.15 60.27 Favored 'Trans proline' 0 N--CA 1.457 -0.668 0 C-N-CA 121.518 1.479 . . . . 0.0 111.206 -177.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -69.55 -25.54 64.06 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 124.973 1.309 . . . . 0.0 111.509 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.737 HD12 ' HB3' ' A' ' 461' ' ' ASN . 25.9 mt -61.81 -15.09 38.9 Favored 'General case' 0 C--N 1.347 0.466 0 CA-C-N 119.285 0.948 . . . . 0.0 110.155 173.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.524 ' HB2' HD21 ' A' ' 458' ' ' LEU . . . -61.65 -40.44 94.91 Favored 'General case' 0 N--CA 1.446 -0.649 0 O-C-N 121.219 -0.925 . . . . 0.0 110.039 173.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 83.4 m -72.88 -17.93 61.47 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.882 -1.136 . . . . 0.0 111.348 178.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 3.5 mt -84.99 -27.68 26.29 Favored 'General case' 0 CA--C 1.528 0.111 0 C-N-CA 124.267 1.027 . . . . 0.0 109.665 175.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -60.8 144.98 89.19 Favored Pre-proline 0 CA--C 1.545 0.755 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 -176.635 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.595 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.5 Cg_endo -69.86 168.55 21.37 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 C-N-CA 122.165 1.91 . . . . 0.0 111.012 175.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -71.17 1.12 5.69 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 123.878 3.052 . . . . 0.0 114.004 178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.458 HD23 HD12 ' A' ' 474' ' ' LEU . 3.2 mp 72.95 58.76 0.11 Allowed 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 129.396 3.079 . . . . 0.0 109.338 174.245 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -81.02 -37.08 29.74 Favored 'General case' 0 N--CA 1.468 0.455 0 O-C-N 121.322 -0.861 . . . . 0.0 110.938 -173.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -109.1 17.42 21.66 Favored 'General case' 0 N--CA 1.462 0.133 0 C-N-CA 125.295 1.438 . . . . 0.0 112.291 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.458 HD12 HD23 ' A' ' 471' ' ' LEU . 15.2 mt -106.41 -94.9 0.36 Allowed 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 117.232 -1.366 . . . . 0.0 109.004 -174.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 46.6 t0 78.92 142.99 0.08 Allowed 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 127.376 2.271 . . . . 0.0 109.83 177.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -70.93 -19.37 62.59 Favored 'General case' 0 CA--C 1.544 0.722 0 O-C-N 121.135 -0.978 . . . . 0.0 109.805 175.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 48.1 t30 -59.92 -43.17 95.08 Favored 'General case' 0 C--N 1.341 0.212 0 O-C-N 121.078 -1.013 . . . . 0.0 110.07 174.325 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.23 -32.58 43.97 Favored 'General case' 0 C--N 1.343 0.309 0 CA-C-O 118.878 -0.582 . . . . 0.0 110.42 -179.516 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.436 HD12 HD12 ' A' ' 482' ' ' LEU . 60.4 mt -131.9 96.2 20.85 Favored Pre-proline 0 N--CA 1.446 -0.626 0 C-N-CA 125.839 1.655 . . . . 0.0 108.821 -174.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -69.28 1.95 3.68 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 123.428 2.752 . . . . 0.0 113.165 -179.491 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -109.36 -13.53 16.95 Favored Glycine 0 N--CA 1.45 -0.409 0 O-C-N 120.99 -1.069 . . . . 0.0 111.838 174.044 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.656 HD23 ' O ' ' A' ' 482' ' ' LEU . 5.6 tt -61.06 -35.43 76.92 Favored 'General case' 0 N--CA 1.44 -0.962 0 CA-C-O 116.687 -1.625 . . . . 0.0 108.816 174.11 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -41.95 -46.56 5.09 Favored Glycine 0 N--CA 1.479 1.536 0 CA-C-N 119.746 1.157 . . . . 0.0 111.553 177.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.428 ' CD1' HD12 ' A' ' 488' ' ' LEU . 0.2 OUTLIER -60.66 -49.12 78.8 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.581 0.752 . . . . 0.0 110.709 177.756 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -59.8 -46.11 90.24 Favored 'General case' 0 C--O 1.225 -0.234 0 C-N-CA 124.243 1.017 . . . . 0.0 111.274 175.67 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.07 -49.69 76.05 Favored 'General case' 0 CA--C 1.505 -0.785 0 CA-C-O 117.611 -1.185 . . . . 0.0 107.994 -179.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -64.64 -39.65 94.06 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 123.996 0.918 . . . . 0.0 110.601 -176.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.755 HD11 HD21 ' A' ' 516' ' ' LEU . 0.1 OUTLIER -59.13 -54.1 50.8 Favored 'General case' 0 CA--C 1.517 -0.316 0 C-N-CA 124.833 1.253 . . . . 0.0 111.329 174.461 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.822 HG11 HG11 ' A' ' 468' ' ' VAL . 88.8 t -60.04 -46.1 94.67 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.883 0 CA-C-O 116.773 -1.584 . . . . 0.0 108.288 175.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.8 t-20 -54.9 -50.06 69.7 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 126.377 1.871 . . . . 0.0 109.028 -175.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.6 m -58.0 -50.65 72.68 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-O 117.848 -1.072 . . . . 0.0 108.74 173.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 90.1 m -61.2 -36.86 81.04 Favored 'General case' 0 CA--C 1.546 0.793 0 CA-C-N 120.685 1.584 . . . . 0.0 112.75 -178.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -61.13 -21.41 63.7 Favored 'General case' 0 C--N 1.33 -0.278 0 C-N-CA 128.562 2.745 . . . . 0.0 110.974 173.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -96.32 -58.79 1.98 Allowed 'General case' 0 N--CA 1.442 -0.853 0 CA-C-O 117.658 -1.163 . . . . 0.0 108.669 173.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.596 ' HB3' HD13 ' A' ' 498' ' ' LEU . 97.2 mm-40 -46.24 93.06 0.05 OUTLIER Pre-proline 0 CA--C 1.538 0.509 0 C-N-CA 128.345 2.658 . . . . 0.0 112.148 -173.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -73.16 119.84 6.25 Favored 'Trans proline' 0 N--CA 1.45 -1.075 0 C-N-CA 122.653 2.235 . . . . 0.0 110.643 -173.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 66.32 36.99 92.44 Favored Glycine 0 CA--C 1.525 0.705 0 N-CA-C 111.162 -0.775 . . . . 0.0 111.162 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.596 HD13 ' HB3' ' A' ' 495' ' ' GLN . 14.3 tp -61.7 160.94 10.76 Favored 'General case' 0 C--N 1.338 0.1 0 CA-C-O 121.216 0.531 . . . . 0.0 110.139 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -134.97 165.83 24.42 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 107.719 -1.215 . . . . 0.0 107.719 179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 90.3 m -53.68 -41.64 67.1 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 125.381 1.473 . . . . 0.0 109.825 173.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -81.06 -40.81 11.01 Favored Glycine 0 C--N 1.339 0.749 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 -177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.1 tp60 -62.74 -29.43 70.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.052 0.541 . . . . 0.0 111.552 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.09 -53.73 53.39 Favored 'General case' 0 N--CA 1.444 -0.726 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 173.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 13.4 mt -56.86 -37.3 71.11 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 118.38 0.536 . . . . 0.0 111.578 176.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -67.04 -40.53 87.18 Favored 'General case' 0 CA--C 1.543 0.687 0 O-C-N 122.163 -0.336 . . . . 0.0 111.085 177.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 57.7 t60 -66.72 -15.71 63.72 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.777 1.231 . . . . 0.0 111.917 178.028 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -116.87 16.23 15.21 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 125.906 1.682 . . . . 0.0 109.158 179.11 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -56.98 131.8 50.9 Favored 'General case' 0 C--N 1.34 0.172 0 O-C-N 120.465 -1.397 . . . . 0.0 108.936 -178.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 68.63 32.62 74.85 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-O 119.683 -0.51 . . . . 0.0 112.456 173.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.805 HG22 ' H ' ' A' ' 512' ' ' ASN . 32.2 m -110.41 147.68 33.52 Favored 'General case' 0 N--CA 1.456 -0.167 0 C-N-CA 124.602 1.161 . . . . 0.0 108.485 179.265 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -61.09 -22.1 64.3 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 111.424 176.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.805 ' H ' HG22 ' A' ' 510' ' ' THR . 5.2 m-20 -92.26 -16.95 25.46 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 124.884 1.274 . . . . 0.0 109.775 179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -52.96 -47.55 68.03 Favored 'General case' 0 C--O 1.212 -0.889 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.58 -45.83 63.26 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 123.899 0.88 . . . . 0.0 112.589 178.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 52.9 m -66.27 -43.99 84.87 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 121.866 -0.521 . . . . 0.0 109.843 178.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.755 HD21 HD11 ' A' ' 488' ' ' LEU . 50.3 mt -61.73 -38.39 87.77 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.818 1.247 . . . . 0.0 111.808 176.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -71.07 -41.02 71.25 Favored 'General case' 0 C--N 1.333 -0.121 0 C-N-CA 127.314 2.246 . . . . 0.0 109.399 -178.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 4.8 tttt -61.38 -38.44 87.02 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 173.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 86.7 mt -78.55 -11.53 59.97 Favored 'General case' 0 CA--C 1.539 0.534 0 CA-C-O 118.694 -0.669 . . . . 0.0 112.634 175.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 22.7 t -79.75 -55.69 4.82 Favored 'General case' 0 C--O 1.224 -0.26 0 CA-C-N 119.186 0.903 . . . . 0.0 108.769 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -74.01 5.99 3.79 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.279 1.431 . . . . 0.0 113.256 176.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 2.1 t90 -61.56 126.35 27.05 Favored 'General case' 0 N--CA 1.447 -0.623 0 O-C-N 121.628 -0.67 . . . . 0.0 110.362 -173.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -110.82 6.22 21.22 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 126.908 2.083 . . . . 0.0 109.823 -174.536 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -66.59 -30.57 70.88 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 120.558 -1.339 . . . . 0.0 109.958 178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.573 HD13 ' CD2' ' A' ' 457' ' ' LEU . 1.1 pt -113.31 -77.91 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.449 -0.491 0 C-N-CA 129.148 2.979 . . . . 0.0 110.824 -174.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.7 57.75 5.65 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.286 1.434 . . . . 0.0 111.295 -179.17 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -145.84 179.47 7.43 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.519 -0.738 . . . . 0.0 110.183 176.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 25.1 pttt -128.48 -37.88 1.78 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 127.444 2.297 . . . . 0.0 110.545 174.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -79.32 -59.74 2.64 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 126.096 1.758 . . . . 0.0 108.962 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 32.1 mt -60.23 -24.77 31.6 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.359 0 CA-C-O 117.852 -1.071 . . . . 0.0 108.253 176.379 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -53.6 -66.75 0.34 Allowed 'General case' 0 C--N 1.347 0.473 0 C-N-CA 125.012 1.325 . . . . 0.0 110.199 176.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.63 -45.83 63.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.184 0.594 . . . . 0.0 110.274 -179.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 2.1 tt0 -62.65 -50.88 69.47 Favored 'General case' 0 N--CA 1.445 -0.69 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.573 -176.631 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . 0.565 ' CG2' HD12 ' A' ' 453' ' ' ILE . 9.7 m -61.01 -34.43 74.82 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 126.331 1.852 . . . . 0.0 110.867 176.566 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.452 ' CD1' HD13 ' A' ' 464' ' ' LEU . 78.9 t80 -63.1 -57.23 11.28 Favored 'General case' 0 N--CA 1.449 -0.502 0 CA-C-N 119.204 0.911 . . . . 0.0 109.593 178.049 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 43.8 m -60.0 -42.2 93.75 Favored 'General case' 0 N--CA 1.449 -0.49 0 CA-C-O 117.982 -1.009 . . . . 0.0 109.4 177.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -54.85 -47.11 74.58 Favored 'General case' 0 C--O 1.22 -0.469 0 C-N-CA 125.483 1.513 . . . . 0.0 110.354 177.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 1.3 t -62.67 -56.19 19.98 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 125.851 1.66 . . . . 0.0 109.901 176.591 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.518 HD21 ' HG3' ' A' ' 469' ' ' PRO . 0.4 OUTLIER -48.63 -57.26 6.5 Favored 'General case' 0 C--O 1.217 -0.645 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.805 177.353 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 4.6 m-20 -54.76 -44.24 73.45 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 126.826 2.05 . . . . 0.0 109.801 178.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 15.1 t-80 -60.75 -44.04 97.21 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.473 1.109 . . . . 0.0 111.621 175.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -56.97 11.65 Favored 'General case' 0 N--CA 1.451 -0.389 0 N-CA-C 107.272 -1.381 . . . . 0.0 107.272 -178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.453 ' CD1' HD21 ' A' ' 474' ' ' LEU . 27.1 m-85 -56.64 -48.51 77.37 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 123.417 0.448 . . . . 0.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -51.28 -53.98 30.45 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 126.328 1.851 . . . . 0.0 110.734 175.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 43.8 t -53.92 -44.42 70.58 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 48.2 mt -66.95 -43.36 83.35 Favored 'General case' 0 C--O 1.225 -0.215 0 O-C-N 120.72 -1.238 . . . . 0.0 109.275 -179.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 27.9 mt -57.09 -48.52 78.4 Favored 'General case' 0 C--N 1.33 -0.267 0 C-N-CA 125.405 1.482 . . . . 0.0 109.572 174.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.1 tt0 -62.04 -54.4 42.0 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 124.425 1.09 . . . . 0.0 110.214 178.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 20.2 mt -54.7 -38.33 66.91 Favored 'General case' 0 C--O 1.226 -0.136 0 C-N-CA 123.63 0.772 . . . . 0.0 109.558 178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 43.7 ttt180 -65.37 -52.94 50.24 Favored 'General case' 0 C--N 1.343 0.293 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -53.8 -51.05 64.73 Favored 'General case' 0 N--CA 1.445 -0.695 0 C-N-CA 124.517 1.127 . . . . 0.0 108.054 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 20.0 tt0 -62.87 -41.1 99.26 Favored 'General case' 0 N--CA 1.433 -1.321 0 CA-C-O 117.424 -1.274 . . . . 0.0 109.027 -176.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.65 -52.81 62.55 Favored 'General case' 0 C--N 1.342 0.273 0 C-N-CA 127.141 2.177 . . . . 0.0 109.863 177.683 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -58.15 -51.3 70.28 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.852 1.261 . . . . 0.0 108.835 -179.134 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.0 mm -62.88 -37.31 78.88 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.972 0 O-C-N 120.729 -1.232 . . . . 0.0 110.217 175.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -69.25 -10.13 56.35 Favored 'General case' 0 C--O 1.215 -0.738 0 C-N-CA 126.268 1.827 . . . . 0.0 111.057 175.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.9 mtt180 -96.75 9.45 41.67 Favored 'General case' 0 N--CA 1.446 -0.657 0 CA-C-O 116.704 -1.617 . . . . 0.0 109.642 173.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 23.1 tt0 -100.57 -46.67 5.12 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 121.53 1.968 . . . . 0.0 111.198 -179.041 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.13 -16.28 63.94 Favored 'General case' 0 N--CA 1.478 0.969 0 O-C-N 120.883 -1.136 . . . . 0.0 112.595 179.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.616 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.5 t -113.38 -105.33 0.39 Allowed 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 105.347 -2.094 . . . . 0.0 105.347 -179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.616 ' H ' HG23 ' A' ' 560' ' ' THR . 1.2 m170 -44.15 -56.03 4.36 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 128.234 2.614 . . . . 0.0 113.159 -173.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 116.98 133.05 4.98 Favored Glycine 0 C--N 1.335 0.482 0 C-N-CA 128.318 2.866 . . . . 0.0 108.303 -178.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.2 mt -78.41 -171.27 2.36 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 173.669 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.9 m -137.19 171.83 13.9 Favored 'General case' 0 CA--C 1.498 -1.022 0 O-C-N 119.458 -2.026 . . . . 0.0 110.324 176.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -55.24 -48.18 74.31 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 113.248 -1.796 . . . . 0.0 109.05 174.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -72.91 -48.89 33.2 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.371 -176.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 10.6 mt-10 -56.16 -43.34 78.26 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.147 0.579 . . . . 0.0 110.293 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 13.5 ttm-85 -60.76 -37.57 82.3 Favored 'General case' 0 C--N 1.346 0.425 0 O-C-N 121.14 -0.975 . . . . 0.0 111.251 179.384 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.443 HD13 ' HD1' ' A' ' 572' ' ' TRP . 3.3 mm? -74.99 -33.46 61.84 Favored 'General case' 0 N--CA 1.446 -0.632 0 C-N-CA 122.836 0.455 . . . . 0.0 109.916 176.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -60.91 -40.71 94.2 Favored 'General case' 0 C--N 1.33 -0.241 0 O-C-N 120.443 -1.41 . . . . 0.0 107.586 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.7 mt -59.84 -41.98 92.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 116.654 -1.641 . . . . 0.0 110.475 173.273 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.444 ' CE3' ' HG2' ' A' ' 576' ' ' GLN . 0.0 OUTLIER -55.97 -51.41 67.8 Favored 'General case' 0 N--CA 1.451 -0.388 0 CA-C-N 121.261 1.846 . . . . 0.0 106.974 177.818 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.6 m -59.55 -38.17 80.36 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 125.554 1.784 . . . . 0.0 109.123 -173.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.18 -52.69 57.7 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.396 1.478 . . . . 0.0 111.46 176.074 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 26.4 m-80 -61.03 -45.75 93.51 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 126.54 1.936 . . . . 0.0 110.804 -175.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . 0.444 ' HG2' ' CE3' ' A' ' 572' ' ' TRP . 2.1 mp0 -67.43 -26.37 66.38 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-O 118.143 -0.932 . . . . 0.0 110.365 -179.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -66.0 -32.38 73.84 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 124.569 1.148 . . . . 0.0 110.559 173.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 6.4 mt -83.55 -29.85 27.53 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 107.972 -1.121 . . . . 0.0 107.972 179.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -67.45 -51.42 51.71 Favored 'General case' 0 C--N 1.365 1.249 0 CA-C-O 121.994 0.902 . . . . 0.0 110.623 175.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 37.42 86.41 0.01 OUTLIER 'General case' 0 C--N 1.345 0.406 0 C-N-CA 130.569 3.547 . . . . 0.0 110.381 -178.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 13.4 mttt . . . . . 0 N--CA 1.47 0.539 0 O-C-N 120.158 -1.589 . . . . 0.0 110.183 -173.141 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.445 -0.721 0 N-CA-C 107.144 -1.428 . . . . 0.0 107.144 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.1 mpt_? -55.96 -79.16 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 107.823 -1.177 . . . . 0.0 107.823 -178.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . 0.723 HG21 ' HA ' ' A' ' 538' ' ' SER . 2.6 t -159.97 165.16 32.55 Favored 'General case' 0 N--CA 1.435 -1.222 0 N-CA-C 105.807 -1.924 . . . . 0.0 105.807 173.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 11.7 m -138.54 159.37 42.25 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 105.962 -1.866 . . . . 0.0 105.962 177.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 14.6 ptt? -53.04 -26.66 16.52 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 120.06 1.3 . . . . 0.0 112.842 174.746 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 18.9 mmt180 -61.29 -31.95 71.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 115.39 -2.243 . . . . 0.0 111.662 174.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 13.1 mm -63.23 -52.41 58.99 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.093 0 CA-C-N 121.124 1.783 . . . . 0.0 108.791 176.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 10.7 mt -53.13 -50.38 64.62 Favored 'General case' 0 C--N 1.349 0.552 0 CA-C-N 119.522 1.055 . . . . 0.0 110.432 179.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.623 ' O ' HG23 ' A' ' 459' ' ' VAL . 25.4 mt -59.0 -59.71 3.41 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.61 0 CA-C-O 118.228 -0.892 . . . . 0.0 112.329 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.13 -40.82 99.45 Favored Glycine 0 C--O 1.223 -0.535 0 CA-C-N 119.939 1.245 . . . . 0.0 112.54 -173.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.702 ' CD2' HD13 ' A' ' 525' ' ' ILE . 1.0 OUTLIER -61.48 -43.51 98.74 Favored 'General case' 0 C--N 1.324 -0.524 0 O-C-N 121.565 -0.962 . . . . 0.0 108.619 177.095 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.511 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.1 tm? -65.79 -35.75 81.58 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.947 1.299 . . . . 0.0 111.373 175.1 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 455' ' ' ILE . 75.2 t -59.9 -56.3 18.28 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 O-C-N 120.994 -1.066 . . . . 0.0 108.3 174.137 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . 0.518 ' OE1' HG12 ' A' ' 459' ' ' VAL . 2.2 mp0 -75.39 -9.92 58.99 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.981 -0.45 . . . . 0.0 111.944 -177.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -147.14 73.25 12.08 Favored Pre-proline 0 CA--C 1.535 0.392 0 C-N-CA 125.125 1.37 . . . . 0.0 109.894 -177.61 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -65.74 -19.99 59.24 Favored 'Trans proline' 0 C--N 1.346 0.425 0 C-N-CA 122.782 2.321 . . . . 0.0 112.668 -174.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -61.29 -21.82 64.29 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 125.978 1.711 . . . . 0.0 110.153 173.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.425 HD13 ' CD1' ' A' ' 535' ' ' PHE . 76.5 mt -63.82 -13.51 45.1 Favored 'General case' 0 C--N 1.351 0.644 0 O-C-N 120.441 -1.412 . . . . 0.0 110.513 173.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.38 -32.64 74.37 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 119.122 0.874 . . . . 0.0 110.243 173.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.1 m -77.75 -17.35 57.64 Favored 'General case' 0 CA--C 1.534 0.34 0 O-C-N 120.783 -1.198 . . . . 0.0 110.943 176.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -90.79 -11.92 38.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-O 117.605 -1.188 . . . . 0.0 112.244 174.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.549 HG22 ' HD2' ' A' ' 469' ' ' PRO . 2.4 p -94.5 151.28 39.18 Favored Pre-proline 0 CA--C 1.542 0.671 0 N-CA-C 106.593 -1.632 . . . . 0.0 106.593 179.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.549 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.7 Cg_endo -72.77 177.72 7.26 Favored 'Trans proline' 0 CA--C 1.539 0.731 0 C-N-CA 123.42 2.747 . . . . 0.0 112.519 175.574 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 43.0 Cg_endo -73.9 5.22 3.58 Favored 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.421 2.747 . . . . 0.0 114.643 174.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.421 ' HA ' HD13 ' A' ' 474' ' ' LEU 0.254 1.8 mm? 71.18 47.81 0.39 Allowed 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 129.342 3.057 . . . . 0.0 114.291 179.525 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -87.95 -20.09 26.37 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 114.486 1.291 . . . . 0.0 114.486 -173.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 2.3 m-80 -106.05 -3.08 22.0 Favored 'General case' 0 N--CA 1.477 0.906 0 O-C-N 120.448 -1.407 . . . . 0.0 111.895 176.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.654 HD21 ' CE1' ' A' ' 543' ' ' PHE . 3.5 mp -109.1 -78.53 0.59 Allowed 'General case' 0 N--CA 1.44 -0.971 0 C-N-CA 125.511 1.525 . . . . 0.0 108.508 -173.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 11.0 t70 62.61 162.73 0.09 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 126.121 1.768 . . . . 0.0 110.987 -173.274 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -72.8 -21.79 60.93 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.429 -1.419 . . . . 0.0 108.755 176.22 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 23.5 t-20 -51.74 -43.29 62.84 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 128.159 2.584 . . . . 0.0 110.032 173.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 43.3 mttt -84.09 -49.7 8.65 Favored 'General case' 0 C--N 1.341 0.203 0 CA-C-O 118.992 -0.528 . . . . 0.0 111.477 174.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 13.0 mt -114.28 102.22 54.67 Favored Pre-proline 0 N--CA 1.47 0.556 0 C-N-CA 123.588 0.755 . . . . 0.0 112.034 -173.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -73.21 -26.03 15.18 Favored 'Trans proline' 0 CA--C 1.531 0.346 0 C-N-CA 122.56 2.174 . . . . 0.0 111.422 -174.191 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -85.91 -15.98 64.19 Favored Glycine 0 CA--C 1.533 1.182 0 CA-C-O 118.646 -1.086 . . . . 0.0 112.656 174.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.27 -25.55 65.22 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 119.021 1.41 . . . . 0.0 108.806 173.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -43.66 -48.35 7.38 Favored Glycine 0 C--O 1.218 -0.895 0 CA-C-N 119.85 1.205 . . . . 0.0 111.146 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.94 -46.81 87.08 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 118.154 0.977 . . . . 0.0 110.677 176.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 37.8 t80 -59.74 -49.37 78.01 Favored 'General case' 0 C--O 1.224 -0.247 0 O-C-N 121.596 -0.69 . . . . 0.0 110.846 176.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -64.66 -44.85 89.1 Favored 'General case' 0 C--O 1.216 -0.674 0 C-N-CA 124.881 1.272 . . . . 0.0 110.028 -175.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -57.37 -49.45 76.12 Favored 'General case' 0 CA--C 1.518 -0.283 0 C-N-CA 124.753 1.221 . . . . 0.0 108.131 176.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 6.2 mt -60.15 -51.33 70.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 CA-C-O 118.319 -0.848 . . . . 0.0 111.342 -179.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.49 HG11 ' CG1' ' A' ' 468' ' ' VAL . 38.6 t -56.69 -46.79 83.1 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 C-N-CA 124.656 1.182 . . . . 0.0 109.935 176.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -58.32 -46.76 85.57 Favored 'General case' 0 N--CA 1.467 0.381 0 C-N-CA 125.019 1.327 . . . . 0.0 108.587 -176.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . 0.409 HG21 ' HE1' ' A' ' 507' ' ' TYR . 18.1 m -64.53 -39.68 94.21 Favored 'General case' 0 N--CA 1.441 -0.878 0 C-N-CA 124.188 0.995 . . . . 0.0 110.364 173.388 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.511 ' SG ' HD11 ' A' ' 458' ' ' LEU . 81.1 m -62.99 -41.96 99.71 Favored 'General case' 0 C--O 1.224 -0.259 0 CA-C-N 120.777 1.626 . . . . 0.0 110.775 179.807 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.57 -22.84 67.08 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 125.667 1.587 . . . . 0.0 111.355 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.1 t -85.25 -50.44 7.36 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 123.752 0.821 . . . . 0.0 110.206 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 5.6 mm100 -67.6 104.44 0.66 Allowed Pre-proline 0 CA--C 1.54 0.56 0 C-N-CA 126.3 1.84 . . . . 0.0 110.424 -174.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -68.09 122.55 9.64 Favored 'Trans proline' 0 N--CA 1.451 -0.994 0 C-N-CA 122.097 1.865 . . . . 0.0 110.018 -174.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.12 40.4 99.14 Favored Glycine 0 C--N 1.34 0.764 0 N-CA-C 111.984 -0.446 . . . . 0.0 111.984 -178.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.748 HD21 HD13 ' A' ' 503' ' ' LEU . 34.8 tp -57.35 155.64 8.82 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-O 122.255 1.026 . . . . 0.0 110.662 175.552 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 2.4 p -143.0 163.36 32.99 Favored 'General case' 0 CA--C 1.531 0.247 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 -179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 37.4 m -50.41 -48.58 56.06 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 126.653 1.981 . . . . 0.0 110.431 174.047 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.59 -45.6 17.36 Favored Glycine 0 CA--C 1.529 0.942 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 -175.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.8 tp60 -59.89 -24.41 64.26 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.757 1.223 . . . . 0.0 111.569 176.322 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.748 HD13 HD21 ' A' ' 498' ' ' LEU . 9.7 tp -61.66 -49.45 76.47 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 119.666 1.121 . . . . 0.0 110.097 175.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' A' ' 517' ' ' GLU . 3.1 mp -64.25 -33.58 76.13 Favored 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 118.883 -0.579 . . . . 0.0 111.818 176.31 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -68.87 -45.78 70.13 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.734 0.814 . . . . 0.0 108.836 -178.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 63.4 t60 -63.59 -17.17 62.58 Favored 'General case' 0 N--CA 1.466 0.338 0 O-C-N 120.952 -1.093 . . . . 0.0 113.04 174.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.5 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 20.5 m-85 -110.81 13.6 22.28 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.315 1.446 . . . . 0.0 109.1 177.362 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -56.19 129.45 40.22 Favored 'General case' 0 N--CA 1.466 0.354 0 O-C-N 119.576 -1.952 . . . . 0.0 109.133 -176.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 78.64 8.2 87.79 Favored Glycine 0 CA--C 1.533 1.204 0 CA-C-O 118.979 -0.901 . . . . 0.0 113.967 176.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.787 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -92.5 146.85 23.36 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 119.058 1.429 . . . . 0.0 108.412 -179.699 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.15 -19.64 54.76 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 121.174 -0.954 . . . . 0.0 111.043 176.207 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.787 ' H ' HG22 ' A' ' 510' ' ' THR . 1.6 m-20 -94.22 -18.68 21.45 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 126.492 1.917 . . . . 0.0 111.508 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . 0.5 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -49.96 -40.75 44.81 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.538 1.135 . . . . 0.0 110.608 176.134 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.6 -48.61 66.18 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 127.461 2.304 . . . . 0.0 110.081 174.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . 0.545 HG22 HD11 ' A' ' 519' ' ' LEU . 6.8 m -58.51 -54.16 50.21 Favored 'General case' 0 N--CA 1.442 -0.851 0 CA-C-O 117.061 -1.447 . . . . 0.0 107.285 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.43 HD13 ' HA ' ' A' ' 516' ' ' LEU . 2.6 mm? -53.95 -42.49 68.93 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 119.76 1.164 . . . . 0.0 110.878 179.421 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.605 ' HA ' HD21 ' A' ' 504' ' ' LEU . 6.3 tt0 -62.58 -46.71 87.1 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 126.304 1.842 . . . . 0.0 111.405 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.71 -32.51 72.35 Favored 'General case' 0 CA--C 1.519 -0.233 0 CA-C-O 118.532 -0.747 . . . . 0.0 110.471 179.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.545 HD11 HG22 ' A' ' 515' ' ' THR . 31.4 mt -76.44 -22.74 54.24 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-O 116.025 -1.941 . . . . 0.0 110.169 174.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.1 t -65.17 -58.8 5.07 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 121.334 1.879 . . . . 0.0 111.824 -178.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.99 1.38 5.73 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.479 1.511 . . . . 0.0 113.517 175.065 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.53 ' CE3' HD11 ' A' ' 525' ' ' ILE . 2.7 t90 -71.46 86.15 0.85 Allowed 'General case' 0 N--CA 1.446 -0.63 0 C-N-CA 124.428 1.091 . . . . 0.0 109.591 -173.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -100.19 -12.7 19.36 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.719 179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 5.5 t70 -53.63 -13.65 0.7 Allowed 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 128.028 2.531 . . . . 0.0 114.159 -178.604 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.702 HD13 ' CD2' ' A' ' 457' ' ' LEU . 4.3 mt -57.61 -78.64 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.442 -0.842 0 C-N-CA 128.406 2.682 . . . . 0.0 111.685 173.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -171.28 -86.7 0.01 OUTLIER 'General case' 0 C--O 1.214 -0.807 0 CA-C-O 124.166 1.936 . . . . 0.0 114.165 -172.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -157.84 158.15 34.61 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 127.048 2.139 . . . . 0.0 111.649 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -63.9 -27.54 69.22 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 119.175 0.898 . . . . 0.0 112.746 174.588 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -71.36 -50.97 26.84 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 120.077 1.308 . . . . 0.0 109.416 176.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 10.5 mt -74.46 -4.17 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 C-N-CA 125.584 1.554 . . . . 0.0 109.857 179.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -60.03 -63.35 1.33 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 119.553 1.07 . . . . 0.0 108.715 179.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 10.4 tt0 -51.62 -43.75 62.68 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 122.7 0.4 . . . . 0.0 110.215 -177.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -54.06 51.26 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.568 0.747 . . . . 0.0 111.399 175.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 57.8 m -57.23 -35.74 70.05 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 124.512 1.125 . . . . 0.0 110.641 176.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.425 ' CD1' HD13 ' A' ' 464' ' ' LEU . 87.5 t80 -67.12 -57.9 5.91 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 119.095 0.862 . . . . 0.0 111.077 177.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.8 m -54.69 -45.03 73.91 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-O 118.069 -0.967 . . . . 0.0 109.183 179.525 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -62.0 -38.85 90.18 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 119.315 0.961 . . . . 0.0 110.575 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.723 ' HA ' HG21 ' A' ' 449' ' ' THR . 1.6 t -62.98 -56.98 12.36 Favored 'General case' 0 CA--C 1.517 -0.32 0 C-N-CA 125.081 1.352 . . . . 0.0 110.672 174.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -49.09 -48.22 44.49 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.678 1.191 . . . . 0.0 108.19 177.167 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.1 m-20 -57.9 -49.62 76.11 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 109.006 -0.738 . . . . 0.0 109.006 -178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 1.9 t-160 -61.57 -35.27 77.32 Favored 'General case' 0 N--CA 1.45 -0.465 0 C-N-CA 124.777 1.231 . . . . 0.0 113.033 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.7 -55.23 28.65 Favored 'General case' 0 C--O 1.223 -0.327 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 173.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.654 ' CE1' HD21 ' A' ' 474' ' ' LEU . 8.9 m-85 -59.89 -43.14 94.95 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 118.36 -0.828 . . . . 0.0 111.285 -178.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 39.3 t0 -55.4 -51.64 66.17 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 127.775 2.43 . . . . 0.0 110.206 174.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 14.8 t -52.08 -49.31 63.79 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.295 1.038 . . . . 0.0 110.194 173.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.492 HD13 ' HG ' ' A' ' 474' ' ' LEU . 33.0 mt -67.13 -39.67 86.66 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 124.183 0.993 . . . . 0.0 110.652 -174.273 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -65.63 -43.67 88.77 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 126.307 1.843 . . . . 0.0 109.696 175.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.06 -51.47 69.05 Favored 'General case' 0 N--CA 1.467 0.375 0 C-N-CA 126.245 1.818 . . . . 0.0 109.298 176.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 4.5 mt -55.26 -51.6 66.11 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 124.74 1.216 . . . . 0.0 108.994 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 3.9 ttm-85 -58.82 -53.39 58.95 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 118.615 -0.707 . . . . 0.0 110.709 178.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -48.85 -51.81 27.64 Favored 'General case' 0 N--CA 1.454 -0.266 0 C-N-CA 124.827 1.251 . . . . 0.0 109.403 177.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 3.7 tp10 -68.04 -38.53 82.63 Favored 'General case' 0 N--CA 1.441 -0.899 0 CA-C-O 117.668 -1.158 . . . . 0.0 109.467 -175.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -56.59 -50.83 70.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 126.106 1.762 . . . . 0.0 108.939 176.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.634 ' HB3' HD11 ' A' ' 571' ' ' LEU . 2.5 mt -57.9 -53.31 59.65 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 125.973 1.709 . . . . 0.0 108.96 176.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 48.3 mm -64.5 -35.44 74.51 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.009 0 CA-C-N 121.134 1.788 . . . . 0.0 109.985 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.17 -24.78 67.8 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 120.658 -1.276 . . . . 0.0 110.754 176.549 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 2.4 mtt-85 -96.5 -1.54 47.05 Favored 'General case' 0 CA--C 1.535 0.401 0 CA-C-O 116.179 -1.867 . . . . 0.0 109.773 174.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -85.07 -43.11 14.2 Favored 'General case' 0 N--CA 1.468 0.456 0 CA-C-N 122.974 2.625 . . . . 0.0 111.119 175.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 4.2 mtt-85 -72.05 -3.76 24.82 Favored 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 127.601 2.36 . . . . 0.0 115.034 -179.097 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.531 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.0 OUTLIER -138.63 -89.31 0.22 Allowed 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -176.911 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.531 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -48.49 -41.46 29.94 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 126.21 1.804 . . . . 0.0 112.054 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 72.36 80.04 0.42 Allowed Glycine 0 N--CA 1.447 -0.568 0 N-CA-C 109.08 -1.608 . . . . 0.0 109.08 -173.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.45 158.27 0.29 Allowed 'General case' 0 C--O 1.238 0.487 0 O-C-N 124.937 1.022 . . . . 0.0 109.823 172.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.84 160.87 25.11 Favored 'General case' 0 N--CA 1.431 -1.405 0 CA-C-O 122.036 0.922 . . . . 0.0 110.489 -173.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -57.71 -37.84 74.22 Favored 'General case' 0 N--CA 1.458 -0.035 0 CA-C-O 118.661 -0.685 . . . . 0.0 109.792 -177.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.87 -53.34 57.08 Favored 'General case' 0 C--O 1.221 -0.404 0 C-N-CA 125.717 1.607 . . . . 0.0 110.189 175.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -40.92 73.15 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 120.293 1.406 . . . . 0.0 112.457 174.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.46 ' HA ' HD12 ' A' ' 571' ' ' LEU . 20.3 ttm180 -63.1 -37.36 86.9 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 120.381 -1.45 . . . . 0.0 110.158 176.702 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.415 HD23 ' HD1' ' A' ' 572' ' ' TRP . 4.8 mt -71.13 -38.84 72.28 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-O 117.042 -1.456 . . . . 0.0 108.958 177.307 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -50.91 -44.12 59.96 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 119.424 1.011 . . . . 0.0 109.361 177.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.634 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.4 mt -56.58 -41.34 76.78 Favored 'General case' 0 C--O 1.223 -0.291 0 CA-C-O 117.053 -1.451 . . . . 0.0 114.331 173.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.415 ' HD1' HD23 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -62.94 -45.66 91.44 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-N 121.982 2.174 . . . . 0.0 107.085 179.482 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.63 -54.11 49.88 Favored 'General case' 0 N--CA 1.443 -0.809 0 N-CA-C 106.902 -1.518 . . . . 0.0 106.902 179.132 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.38 -41.77 66.24 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 126.038 1.735 . . . . 0.0 111.825 179.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 8.1 m-80 -66.22 -39.7 89.78 Favored 'General case' 0 N--CA 1.473 0.703 0 O-C-N 120.55 -1.344 . . . . 0.0 109.885 -177.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -74.7 -21.42 59.4 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 117.846 -1.073 . . . . 0.0 111.152 177.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 84.1 mt-10 -81.15 -34.63 32.3 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 125.485 1.514 . . . . 0.0 111.359 174.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -80.47 -27.3 37.87 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.959 1.304 . . . . 0.0 111.464 174.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 48.94 67.97 0.78 Allowed 'General case' 0 C--O 1.236 0.381 0 C-N-CA 126.237 1.815 . . . . 0.0 111.373 177.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 13.6 pttt -102.15 154.05 19.37 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.637 176.582 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt . . . . . 0 C--O 1.238 0.494 0 N-CA-C 105.553 -2.018 . . . . 0.0 105.553 173.305 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 12.8 mttt . . . . . 0 N--CA 1.462 0.152 0 CA-C-O 119.699 -0.191 . . . . 0.0 110.613 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 179.52 177.65 0.57 Allowed 'General case' 0 CA--C 1.514 -0.415 0 C-N-CA 127.612 2.365 . . . . 0.0 106.505 -177.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . 0.414 HG21 ' HA ' ' A' ' 538' ' ' SER . 77.1 m 64.02 112.68 0.03 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 O-C-N 126.048 2.092 . . . . 0.0 109.224 -179.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 24.5 m -135.27 162.04 33.68 Favored 'General case' 0 C--O 1.222 -0.383 0 O-C-N 119.997 -1.69 . . . . 0.0 107.731 177.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -50.72 -28.84 9.89 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.636 1.574 . . . . 0.0 112.963 174.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -56.44 -42.53 78.27 Favored 'General case' 0 C--O 1.216 -0.677 0 CA-C-O 116.1 -1.905 . . . . 0.0 109.246 173.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.6 mm -58.24 -52.88 53.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.588 0 N-CA-C 106.595 -1.632 . . . . 0.0 106.595 178.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 14.2 mt -50.88 -47.67 60.51 Favored 'General case' 0 C--O 1.224 -0.279 0 CA-C-N 120.2 1.363 . . . . 0.0 110.264 179.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.571 HG23 HD13 ' A' ' 488' ' ' LEU . 56.5 mt -62.35 -58.07 9.24 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.603 0 C-N-CA 124.969 1.307 . . . . 0.0 110.765 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -58.81 -37.52 90.51 Favored Glycine 0 N--CA 1.469 0.837 0 C-N-CA 126.885 2.183 . . . . 0.0 112.022 -177.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 81.1 mt -65.89 -41.95 90.9 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 117.523 -1.227 . . . . 0.0 108.838 173.587 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.44 -30.3 68.19 Favored 'General case' 0 C--O 1.221 -0.401 0 CA-C-N 120.202 1.365 . . . . 0.0 111.375 175.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.582 ' HA ' HD22 ' A' ' 503' ' ' LEU . 17.4 t -64.11 -54.8 26.85 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.242 0 C-N-CA 124.582 1.153 . . . . 0.0 109.239 177.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 -80.16 -10.12 59.75 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.916 179.492 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.61 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.5 t-20 -138.17 74.11 43.17 Favored Pre-proline 0 N--CA 1.448 -0.528 0 C-N-CA 123.371 0.668 . . . . 0.0 110.783 178.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 20.8 Cg_endo -65.55 -18.45 59.36 Favored 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 121.881 1.721 . . . . 0.0 112.066 -177.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -72.23 -20.68 61.51 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 123.839 0.856 . . . . 0.0 110.329 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.61 HD12 ' HB3' ' A' ' 461' ' ' ASN . 27.3 mt -62.68 -12.81 25.87 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-N 120.926 1.694 . . . . 0.0 110.029 176.593 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -63.89 -32.87 74.54 Favored 'General case' 0 N--CA 1.443 -0.786 0 C-N-CA 124.015 0.926 . . . . 0.0 111.13 173.386 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 51.6 m -78.59 -17.04 56.69 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 119.685 1.13 . . . . 0.0 111.262 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.8 mt -89.52 -23.37 22.06 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 124.753 1.221 . . . . 0.0 110.821 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.781 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.3 OUTLIER -78.54 150.78 76.79 Favored Pre-proline 0 CA--C 1.54 0.562 0 CA-C-N 118.54 0.609 . . . . 0.0 109.464 -179.529 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.781 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.6 Cg_endo -75.56 168.31 24.7 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 122.435 2.09 . . . . 0.0 112.124 176.172 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -68.49 3.87 1.97 Allowed 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 124.703 3.602 . . . . 0.0 113.647 175.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.571 HD22 ' HG3' ' A' ' 486' ' ' ARG . 3.2 mp 68.54 63.47 0.34 Allowed 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 126.604 1.962 . . . . 0.0 110.739 176.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -89.74 -38.98 13.45 Favored 'General case' 0 CA--C 1.545 0.775 0 CA-C-O 121.779 0.8 . . . . 0.0 111.138 -177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -108.39 0.56 21.19 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 128.452 2.701 . . . . 0.0 110.808 -176.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.58 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.7 mm? -84.16 -91.15 0.09 Allowed 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 103.247 -2.872 . . . . 0.0 103.247 -177.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 41.6 t0 65.02 150.36 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 125.764 1.626 . . . . 0.0 110.72 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . 0.419 ' HG2' ' CA ' ' A' ' 483' ' ' GLY . 12.2 mt-10 -78.63 -17.97 55.21 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 120.147 -1.596 . . . . 0.0 109.072 -179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.33 -31.47 70.32 Favored 'General case' 0 N--CA 1.456 -0.157 0 C-N-CA 125.195 1.398 . . . . 0.0 111.216 176.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 14.6 mttp -94.93 -27.43 15.68 Favored 'General case' 0 N--CA 1.454 -0.228 0 CA-C-O 118.874 -0.584 . . . . 0.0 110.748 175.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 546' ' ' LEU . 3.0 mm? -125.06 89.01 53.34 Favored Pre-proline 0 C--O 1.237 0.433 0 CA-C-N 119.321 0.964 . . . . 0.0 110.801 -176.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -68.96 76.51 0.83 Allowed 'Trans proline' 0 CA--C 1.541 0.865 1 C-N-CA 125.962 4.442 . . . . 0.0 110.378 -175.175 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 144.7 -19.09 2.01 Favored Glycine 0 CA--C 1.529 0.92 0 C-N-CA 125.884 1.707 . . . . 0.0 113.905 -176.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 1.3 tp -60.94 -25.12 66.57 Favored 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 116.973 -1.489 . . . . 0.0 109.543 173.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . 0.419 ' CA ' ' HG2' ' A' ' 476' ' ' GLU . . . -44.22 -42.32 6.82 Favored Glycine 0 C--O 1.217 -0.928 0 CA-C-N 120.449 1.477 . . . . 0.0 110.763 174.412 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.519 HD23 HD13 ' A' ' 455' ' ' ILE . 33.1 tp -58.17 -51.09 71.16 Favored 'General case' 0 CA--C 1.537 0.477 0 CA-C-N 118.554 1.177 . . . . 0.0 112.643 176.263 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.416 ' O ' HG23 ' A' ' 489' ' ' VAL . 80.0 t80 -58.2 -52.46 65.49 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 126.303 1.841 . . . . 0.0 110.79 173.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.571 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.1 OUTLIER -53.35 -51.58 62.01 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 125.671 1.588 . . . . 0.0 108.58 -179.738 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -67.39 -42.42 83.37 Favored 'General case' 0 C--O 1.225 -0.213 0 C-N-CA 125.23 1.412 . . . . 0.0 109.974 -176.705 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.571 HD13 HG23 ' A' ' 455' ' ' ILE . 0.2 OUTLIER -57.78 -48.69 78.95 Favored 'General case' 0 CA--C 1.51 -0.581 0 C-N-CA 124.481 1.112 . . . . 0.0 110.615 177.131 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.77 HG11 HG11 ' A' ' 468' ' ' VAL . 84.5 t -63.62 -48.12 88.2 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.63 0 CA-C-O 117.756 -1.116 . . . . 0.0 108.356 175.837 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 12.7 t-20 -52.34 -41.65 63.21 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 120.117 1.326 . . . . 0.0 109.77 -178.52 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.9 m -72.01 -42.16 66.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 C-N-CA 126.513 1.925 . . . . 0.0 112.019 176.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 97.7 m -62.56 -39.77 94.73 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.199 1.363 . . . . 0.0 110.549 176.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -64.04 -24.26 67.64 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.914 1.686 . . . . 0.0 111.975 173.852 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.58 -56.71 4.3 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 125.518 1.527 . . . . 0.0 107.997 174.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -67.9 100.0 0.23 Allowed Pre-proline 0 N--CA 1.452 -0.341 0 C-N-CA 124.353 1.061 . . . . 0.0 111.267 -173.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -61.28 138.25 75.92 Favored 'Trans proline' 0 N--CA 1.44 -1.621 0 N-CA-C 107.274 -1.856 . . . . 0.0 107.274 -177.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 55.93 36.61 67.36 Favored Glycine 0 N--CA 1.475 1.262 0 C-N-CA 124.528 1.061 . . . . 0.0 112.833 173.692 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.624 HD23 ' HB3' ' A' ' 462' ' ' PRO . 7.2 tp -64.28 151.62 43.25 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 107.584 -1.265 . . . . 0.0 107.584 -177.747 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -122.78 163.81 19.51 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 127.309 2.243 . . . . 0.0 107.665 -177.892 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 91.6 m -58.57 -44.03 89.61 Favored 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 124.208 1.003 . . . . 0.0 111.18 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -72.46 -34.04 60.73 Favored Glycine 0 CA--C 1.535 1.341 0 N-CA-C 110.092 -1.203 . . . . 0.0 110.092 177.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -67.38 -29.0 68.41 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 118.616 1.208 . . . . 0.0 111.531 -177.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.582 HD22 ' HA ' ' A' ' 459' ' ' VAL . 13.8 tp -58.87 -51.96 67.78 Favored 'General case' 0 N--CA 1.443 -0.801 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 174.121 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -58.65 -30.22 67.15 Favored 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.454 0.702 . . . . 0.0 111.569 177.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -71.86 -43.73 64.98 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 119.11 0.868 . . . . 0.0 112.468 176.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -63.86 -18.28 64.0 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 126.078 1.751 . . . . 0.0 111.859 173.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.521 ' CD2' HD13 ' A' ' 516' ' ' LEU . 69.1 m-85 -117.58 17.71 14.39 Favored 'General case' 0 N--CA 1.443 -0.792 0 C-N-CA 126.697 1.999 . . . . 0.0 110.688 179.762 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.1 ttt-85 -62.03 -19.22 62.65 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 121.357 1.89 . . . . 0.0 114.158 -176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -136.06 42.26 1.34 Allowed Glycine 0 C--O 1.227 -0.311 0 C-N-CA 124.996 1.284 . . . . 0.0 110.852 -179.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.707 HG22 ' H ' ' A' ' 512' ' ' ASN . 48.7 m -108.09 145.99 33.26 Favored 'General case' 0 C--O 1.221 -0.43 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 179.193 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 10.3 t30 -62.47 -21.35 65.39 Favored 'General case' 0 CA--C 1.549 0.917 0 O-C-N 121.217 -0.927 . . . . 0.0 112.011 174.524 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.707 ' H ' HG22 ' A' ' 510' ' ' THR . 4.4 m-20 -88.95 -26.28 21.62 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 130.817 3.647 . . . . 0.0 109.675 179.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . 0.473 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -40.49 -43.89 1.93 Allowed 'General case' 0 C--O 1.206 -1.203 0 C-N-CA 124.24 1.016 . . . . 0.0 110.426 178.194 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.77 -52.63 47.39 Favored 'General case' 0 N--CA 1.448 -0.538 0 C-N-CA 125.876 1.67 . . . . 0.0 113.217 176.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 89.7 m -63.73 -45.21 90.91 Favored 'General case' 0 C--N 1.324 -0.517 0 C-N-CA 124.842 1.257 . . . . 0.0 109.693 174.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.521 HD13 ' CD2' ' A' ' 507' ' ' TYR . 42.9 mt -60.52 -34.52 74.22 Favored 'General case' 0 C--N 1.329 -0.301 0 C-N-CA 124.292 1.037 . . . . 0.0 111.21 177.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -73.21 -40.77 64.46 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 127.04 2.136 . . . . 0.0 109.412 -178.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 12.9 tttm -64.55 -37.94 89.3 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 109.638 -0.504 . . . . 0.0 109.638 174.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.497 HD22 ' CE3' ' A' ' 522' ' ' TRP . 88.0 mt -77.32 -10.9 59.72 Favored 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 118.395 -0.812 . . . . 0.0 112.515 173.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 9.4 t -69.92 -66.04 0.64 Allowed 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 125.192 1.397 . . . . 0.0 108.388 177.786 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.38 14.36 2.03 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 126.459 1.904 . . . . 0.0 111.742 179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.678 ' CE3' HD11 ' A' ' 525' ' ' ILE . 4.4 t90 -53.69 123.97 13.8 Favored 'General case' 0 C--O 1.248 1.005 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -176.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -94.18 -28.62 15.55 Favored 'General case' 0 N--CA 1.477 0.891 0 CA-C-N 114.727 -1.124 . . . . 0.0 110.281 -173.583 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.5 t0 -49.75 -30.26 9.12 Favored 'General case' 0 N--CA 1.496 1.853 0 C-N-CA 125.502 1.521 . . . . 0.0 111.031 -177.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.678 HD11 ' CE3' ' A' ' 522' ' ' TRP . 1.6 pt -110.27 -70.84 0.79 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 130.834 3.654 . . . . 0.0 112.457 175.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.38 52.09 3.67 Favored 'General case' 0 C--N 1.347 0.464 0 C-N-CA 126.877 2.071 . . . . 0.0 112.311 -179.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 531' ' ' ALA . 3.3 t70 -151.11 150.21 30.41 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-N 115.847 -0.615 . . . . 0.0 109.61 -174.138 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 24.8 pttm -106.88 -27.71 10.55 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.364 1.066 . . . . 0.0 111.983 174.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -87.66 -60.75 1.89 Allowed 'General case' 0 CA--C 1.51 -0.584 0 C-N-CA 124.567 1.147 . . . . 0.0 108.936 -177.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 45.0 mt -55.55 -28.12 22.35 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.413 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 175.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB2' ' O ' ' A' ' 527' ' ' ASP . . . -50.69 -60.32 3.16 Favored 'General case' 0 N--CA 1.45 -0.446 0 C-N-CA 124.814 1.246 . . . . 0.0 111.206 173.694 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -52.74 -42.97 65.41 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 119.058 0.844 . . . . 0.0 110.602 179.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.17 -49.48 69.64 Favored 'General case' 0 N--CA 1.442 -0.871 0 C-N-CA 120.347 -0.541 . . . . 0.0 111.31 -179.457 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 61.2 m -58.94 -31.37 68.63 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.156 1.782 . . . . 0.0 107.75 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.524 ' CD1' HD13 ' A' ' 464' ' ' LEU . 39.4 t80 -66.55 -58.05 6.0 Favored 'General case' 0 CA--C 1.506 -0.725 0 C-N-CA 125.868 1.667 . . . . 0.0 109.551 178.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 80.6 m -63.23 -39.6 95.07 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-O 118.349 -0.834 . . . . 0.0 109.706 -179.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -60.02 -45.18 93.62 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.467 1.107 . . . . 0.0 108.361 175.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.414 ' HA ' HG21 ' A' ' 449' ' ' THR . 14.7 t -70.4 -51.77 27.23 Favored 'General case' 0 CA--C 1.516 -0.342 0 O-C-N 120.479 -1.388 . . . . 0.0 112.002 -176.26 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.3 tt -46.8 -49.94 19.13 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 126.708 2.003 . . . . 0.0 111.083 170.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . 0.267 0.9 OUTLIER -65.68 -33.56 76.18 Favored 'General case' 0 C--O 1.207 -1.153 0 CA-C-O 116.04 -1.933 . . . . 0.0 110.342 179.071 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.1 t-80 -72.04 -35.45 69.35 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-N 120.049 1.295 . . . . 0.0 110.36 178.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.56 -57.72 9.25 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 176.515 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.58 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.5 m-85 -58.76 -42.38 88.78 Favored 'General case' 0 CA--C 1.53 0.201 0 C-N-CA 126.487 1.915 . . . . 0.0 111.343 -177.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -58.68 -49.14 78.66 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 127.551 2.341 . . . . 0.0 109.096 176.218 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.6 t -56.59 -35.62 68.44 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.664 -0.684 . . . . 0.0 110.626 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.856 HD21 HD21 ' A' ' 479' ' ' LEU . 16.2 mt -74.0 -40.82 62.67 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.712 1.205 . . . . 0.0 111.087 179.035 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 30.8 mt -61.7 -44.86 96.13 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 117.517 -1.23 . . . . 0.0 109.0 174.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 15.5 tt0 -66.79 -48.68 68.26 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.046 0.938 . . . . 0.0 111.476 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . 0.564 HD23 ' N ' ' A' ' 550' ' ' ARG . 0.2 OUTLIER -54.33 -45.55 72.69 Favored 'General case' 0 CA--C 1.451 -2.85 0 C-N-CA 124.493 1.117 . . . . 0.0 111.346 173.704 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . 0.564 ' N ' HD23 ' A' ' 549' ' ' LEU . 1.3 ttm-85 -63.98 -51.07 66.01 Favored 'General case' 0 C--N 1.272 -2.777 0 N-CA-C 106.753 -1.573 . . . . 0.0 106.753 -176.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -51.69 -51.95 52.04 Favored 'General case' 0 N--CA 1.445 -0.714 0 C-N-CA 124.654 1.182 . . . . 0.0 109.149 176.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -61.89 -43.24 99.26 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-O 118.486 -0.769 . . . . 0.0 109.063 -176.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -62.37 -40.21 95.69 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.196 1.798 . . . . 0.0 110.373 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 571' ' ' LEU . 4.2 mt -60.72 -55.13 36.91 Favored 'General case' 0 N--CA 1.453 -0.287 0 C-N-CA 124.697 1.199 . . . . 0.0 107.835 174.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 39.9 mm -61.57 -39.54 83.4 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-N 120.255 1.389 . . . . 0.0 111.763 179.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -60.25 -18.29 47.87 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.503 1.521 . . . . 0.0 109.542 173.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -95.18 18.49 12.19 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 120.577 1.535 . . . . 0.0 111.39 173.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -115.85 -63.83 1.4 Allowed 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 121.164 1.802 . . . . 0.0 109.523 177.321 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -70.38 -8.8 53.51 Favored 'General case' 0 N--CA 1.443 -0.777 0 CA-C-O 117.699 -1.143 . . . . 0.0 111.181 -178.878 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -111.05 -43.01 3.83 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 120.358 1.435 . . . . 0.0 109.886 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 15.9 m170 -115.06 -74.18 0.62 Allowed 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.495 1.518 . . . . 0.0 109.09 -173.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 148.62 109.18 0.52 Allowed Glycine 0 CA--C 1.525 0.712 0 N-CA-C 108.524 -1.83 . . . . 0.0 108.524 179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 6.8 mt -79.78 132.74 36.22 Favored 'General case' 0 CA--C 1.514 -0.425 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 3.3 t -66.57 165.32 14.86 Favored 'General case' 0 N--CA 1.447 -0.598 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 176.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -59.88 -39.9 86.87 Favored 'General case' 0 N--CA 1.469 0.507 0 C-N-CA 123.596 0.759 . . . . 0.0 110.624 173.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -70.73 -51.56 26.56 Favored 'General case' 0 C--O 1.214 -0.782 0 C-N-CA 123.995 0.918 . . . . 0.0 109.343 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 68.0 mm-40 -59.0 -30.4 67.96 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 123.793 1.759 . . . . 0.0 111.526 -178.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.97 -38.37 72.78 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 118.785 -2.447 . . . . 0.0 106.147 178.799 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 18.4 mt -67.76 -32.9 73.81 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-O 117.902 -1.047 . . . . 0.0 110.487 177.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -51.5 -43.55 62.25 Favored 'General case' 0 CA--C 1.54 0.579 0 CA-C-N 120.131 1.332 . . . . 0.0 108.912 174.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 554' ' ' LEU . 1.0 OUTLIER -61.78 -39.84 93.1 Favored 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 117.423 -1.275 . . . . 0.0 112.803 177.205 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -57.11 -50.48 72.68 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 121.166 1.803 . . . . 0.0 108.172 174.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -61.11 -35.91 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 O-C-N 124.146 0.904 . . . . 0.0 109.404 -175.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -67.51 -52.61 37.0 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 125.789 1.636 . . . . 0.0 110.95 175.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -57.4 -46.22 83.7 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 126.464 1.906 . . . . 0.0 111.468 -179.056 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 89.4 mm-40 -67.8 -24.72 65.33 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.864 0.866 . . . . 0.0 111.66 175.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -79.21 -33.89 43.36 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-N 119.257 0.935 . . . . 0.0 109.346 173.757 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -78.83 -25.49 44.12 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 128.024 2.53 . . . . 0.0 109.869 -176.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -53.56 -48.1 69.43 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.776 1.23 . . . . 0.0 111.73 175.887 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.45 -59.86 0.27 Allowed 'General case' 0 CA--C 1.512 -0.502 0 CA-C-O 118.933 -0.556 . . . . 0.0 110.306 175.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.241 0.628 0 CA-C-O 114.231 -2.795 . . . . 0.0 104.569 174.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.436 ' HE2' ' NE2' ' A' ' 541' ' ' HIS . 3.4 tmtm? . . . . . 0 C--O 1.238 0.499 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 47.9 ttt180 -77.96 69.84 4.25 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 173.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.1 m -143.4 148.92 36.92 Favored 'General case' 0 N--CA 1.434 -1.26 0 C-N-CA 125.307 1.443 . . . . 0.0 108.139 -173.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -120.45 -91.86 0.55 Allowed 'General case' 0 N--CA 1.435 -1.218 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 173.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 46.5 ttm -164.53 -40.39 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.215 0 C-N-CA 124.386 1.075 . . . . 0.0 109.024 175.199 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 7.3 mmm180 -56.02 -19.23 11.85 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 117.612 -1.185 . . . . 0.0 113.26 175.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.4 mm -51.99 -52.14 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 C-N-CA 125.167 1.387 . . . . 0.0 109.409 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.54 -42.71 67.76 Favored 'General case' 0 C--O 1.223 -0.305 0 CA-C-N 118.494 0.588 . . . . 0.0 111.517 -179.649 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.527 HG23 HD22 ' A' ' 488' ' ' LEU . 43.8 mt -69.39 -53.08 26.94 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 C-N-CA 123.227 0.611 . . . . 0.0 109.553 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -64.18 -43.43 97.12 Favored Glycine 0 C--N 1.336 0.534 0 CA-C-N 118.749 0.704 . . . . 0.0 112.679 -173.898 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 90.4 mt -64.22 -41.68 96.92 Favored 'General case' 0 N--CA 1.449 -0.504 0 CA-C-O 118.667 -0.682 . . . . 0.0 110.154 177.353 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.411 HD11 ' SG ' ' A' ' 492' ' ' CYS . 3.4 tm? -64.77 -40.27 95.0 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 118.83 0.741 . . . . 0.0 110.68 177.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 4.4 t -56.63 -50.96 71.69 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.247 0 O-C-N 121.599 -0.688 . . . . 0.0 109.541 173.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 98.2 mt-30 -72.59 -28.63 62.91 Favored 'General case' 0 N--CA 1.449 -0.501 0 CA-C-O 118.674 -0.679 . . . . 0.0 110.293 -174.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 47.8 t-20 -133.55 84.47 45.61 Favored Pre-proline 0 CA--C 1.538 0.505 0 C-N-CA 126.895 2.078 . . . . 0.0 111.643 -178.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 44.1 Cg_endo -65.36 -21.48 61.03 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 121.945 1.763 . . . . 0.0 113.3 -174.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.64 -17.02 62.48 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 119.069 0.849 . . . . 0.0 111.278 177.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 83.4 mt -63.41 -15.58 58.01 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.207 -0.933 . . . . 0.0 110.673 173.77 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -65.77 -25.47 67.27 Favored 'General case' 0 C--N 1.342 0.281 0 CA-C-N 119.452 1.024 . . . . 0.0 111.047 173.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 7.9 m -83.41 -12.82 56.01 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.066 0.946 . . . . 0.0 110.789 176.71 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 20.8 mt -103.17 -7.55 21.15 Favored 'General case' 0 C--N 1.341 0.225 0 C-N-CA 124.584 1.154 . . . . 0.0 112.478 -177.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 489' ' ' VAL . 14.9 p -92.32 137.89 24.5 Favored Pre-proline 0 CA--C 1.545 0.766 0 CA-C-N 119.995 1.27 . . . . 0.0 109.692 -177.804 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -65.05 164.72 24.0 Favored 'Trans proline' 0 CA--C 1.544 0.983 0 C-N-CA 123.17 2.58 . . . . 0.0 110.355 173.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.72 16.57 0.27 Allowed 'Trans proline' 0 CA--C 1.549 1.246 0 C-N-CA 123.474 2.783 . . . . 0.0 115.515 179.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.543 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.5 mm? 69.38 16.4 8.3 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 128.367 2.667 . . . . 0.0 113.249 175.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 3.0 pm0 -57.79 -20.26 34.11 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 128.129 2.572 . . . . 0.0 115.396 -178.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -112.3 10.08 19.97 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.34 1.456 . . . . 0.0 111.826 177.369 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.699 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 5.1 mp -124.13 -58.21 1.56 Allowed 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 124.047 0.939 . . . . 0.0 111.731 -173.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 25.8 t0 64.59 157.25 0.08 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 125.533 1.533 . . . . 0.0 108.866 -173.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -75.27 -21.96 58.14 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 119.711 -1.868 . . . . 0.0 107.576 173.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -61.8 -49.21 77.25 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 127.291 2.237 . . . . 0.0 113.202 179.441 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 48.0 mmtt -77.21 -20.31 55.47 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-O 118.715 -0.659 . . . . 0.0 112.497 -173.303 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -120.78 88.29 43.69 Favored Pre-proline 0 N--CA 1.453 -0.282 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 -177.439 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -66.53 87.95 0.27 Allowed 'Trans proline' 0 CA--C 1.54 0.787 0 C-N-CA 122.99 2.46 . . . . 0.0 111.307 -175.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 140.46 -19.02 2.82 Favored Glycine 0 CA--C 1.533 1.18 0 C-N-CA 126.276 1.893 . . . . 0.0 112.589 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 8.7 tt -62.77 -25.1 68.05 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 118.822 1.311 . . . . 0.0 111.499 174.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -47.66 -40.06 17.12 Favored Glycine 0 CA--C 1.527 0.822 0 CA-C-N 118.607 0.64 . . . . 0.0 112.054 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.462 HD13 HD21 ' A' ' 512' ' ' ASN . 18.1 tp -63.89 -40.91 97.62 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 118.735 1.267 . . . . 0.0 112.696 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 28.7 t80 -61.86 -42.59 99.23 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 120.716 -1.24 . . . . 0.0 109.074 174.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.1 tpm_? -61.91 -47.56 84.38 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 124.294 1.038 . . . . 0.0 110.76 178.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 44.8 tt0 -52.23 -56.44 14.67 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 127.238 2.215 . . . . 0.0 109.473 175.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.527 HD22 HG23 ' A' ' 455' ' ' ILE . 2.8 mp -56.25 -59.68 4.59 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 124.586 1.155 . . . . 0.0 109.784 -178.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.484 HG11 HG11 ' A' ' 468' ' ' VAL . 72.6 t -54.68 -42.86 63.38 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.164 0 C-N-CA 123.361 0.664 . . . . 0.0 109.628 -178.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -59.64 -44.8 93.36 Favored 'General case' 0 CA--C 1.521 -0.136 0 CA-C-N 119.131 0.878 . . . . 0.0 110.798 -178.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 5.5 m -63.76 -41.61 97.96 Favored 'General case' 0 N--CA 1.442 -0.844 0 C-N-CA 123.503 0.721 . . . . 0.0 109.898 175.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 458' ' ' LEU . 88.5 m -62.97 -44.49 95.91 Favored 'General case' 0 C--O 1.226 -0.141 0 CA-C-N 119.002 0.819 . . . . 0.0 110.074 -177.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.08 -18.46 47.05 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.748 1.219 . . . . 0.0 112.817 174.572 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.8 t -99.46 -11.84 20.73 Favored 'General case' 0 CA--C 1.532 0.272 0 C-N-CA 125.901 1.68 . . . . 0.0 113.023 179.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 43.0 mt-30 -106.29 90.69 4.95 Favored Pre-proline 0 CA--C 1.538 0.508 0 C-N-CA 125.234 1.414 . . . . 0.0 109.791 -176.644 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.23 122.7 10.75 Favored 'Trans proline' 0 N--CA 1.456 -0.701 0 C-N-CA 121.845 1.697 . . . . 0.0 110.082 -179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 75.41 30.45 58.48 Favored Glycine 0 CA--C 1.529 0.91 0 CA-C-O 119.481 -0.622 . . . . 0.0 112.406 178.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 37.9 tp -56.07 153.3 9.18 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 117.81 0.805 . . . . 0.0 110.065 174.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.2 p -136.29 166.61 23.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 175.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 10.4 m -47.02 -49.99 20.15 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 125.563 1.545 . . . . 0.0 110.098 174.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.32 -33.46 19.98 Favored Glycine 0 CA--C 1.528 0.878 0 N-CA-C 111.585 -0.606 . . . . 0.0 111.585 -174.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 36.2 tp60 -64.63 -27.19 68.77 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.373 0.669 . . . . 0.0 110.356 -179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 52.9 tp -64.5 -48.65 74.38 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.358 0.663 . . . . 0.0 109.999 173.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 9.7 mp -62.67 -31.11 71.94 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-O 118.9 -0.571 . . . . 0.0 110.969 178.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 10.2 tt0 -68.62 -48.84 63.07 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 118.693 0.679 . . . . 0.0 109.711 173.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 61.5 t60 -65.83 -20.66 66.32 Favored 'General case' 0 CA--C 1.535 0.369 0 O-C-N 121.688 -0.632 . . . . 0.0 112.349 -177.056 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -107.11 8.81 30.39 Favored 'General case' 0 N--CA 1.457 -0.091 0 C-N-CA 123.977 0.911 . . . . 0.0 110.773 179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 18.7 tpt180 -59.24 -14.88 12.43 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 114.625 1.343 . . . . 0.0 114.625 -173.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . -118.54 12.29 12.27 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 124.722 1.153 . . . . 0.0 113.67 174.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.795 HG22 ' H ' ' A' ' 512' ' ' ASN . 90.8 m -94.06 146.97 23.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 119.849 1.825 . . . . 0.0 110.652 -174.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.44 -9.87 9.8 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.396 1.078 . . . . 0.0 112.7 176.037 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.795 ' H ' HG22 ' A' ' 510' ' ' THR . 2.2 t-20 -94.82 -16.51 22.89 Favored 'General case' 0 N--CA 1.464 0.235 0 C-N-CA 126.962 2.105 . . . . 0.0 112.201 177.732 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -43.45 -48.06 7.15 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.626 1.17 . . . . 0.0 113.232 -175.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -58.08 -43.92 87.29 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.311 0.505 . . . . 0.0 111.876 -178.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.3 m -66.87 -37.91 85.32 Favored 'General case' 0 CA--C 1.535 0.394 0 O-C-N 121.722 -0.611 . . . . 0.0 110.726 -179.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 27.8 mt -68.37 -45.33 73.09 Favored 'General case' 0 CA--C 1.522 -0.119 0 C-N-CA 124.29 1.036 . . . . 0.0 110.965 177.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -62.24 -44.76 95.82 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 73.5 tttt -60.98 -35.39 76.68 Favored 'General case' 0 CA--C 1.53 0.183 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.857 175.18 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 39.8 mt -74.94 -27.14 60.07 Favored 'General case' 0 N--CA 1.455 -0.223 0 CA-C-N 120.412 1.46 . . . . 0.0 112.832 175.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 1.2 t -62.64 -47.23 84.63 Favored 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 109.2 -0.667 . . . . 0.0 109.2 176.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER -87.86 12.99 11.67 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.635 1.574 . . . . 0.0 114.188 -179.553 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 9.8 t90 -65.91 125.45 25.44 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.851 0.834 . . . . 0.0 111.732 -174.54 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 20.5 p-10 -81.44 -25.17 36.35 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 130.979 3.712 . . . . 0.0 114.308 -174.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -63.64 -20.15 65.45 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.544 0.737 . . . . 0.0 112.331 -178.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 4.9 pt -125.76 -64.62 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 C-N-CA 124.268 1.027 . . . . 0.0 110.692 -174.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 50.38 3.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 129.823 3.249 . . . . 0.0 118.179 174.459 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -114.92 164.84 13.57 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 119.724 1.147 . . . . 0.0 110.798 174.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.2 pttt -118.3 -13.43 9.84 Favored 'General case' 0 CA--C 1.53 0.205 0 C-N-CA 125.942 1.697 . . . . 0.0 113.097 -176.352 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -88.67 -53.56 4.57 Favored 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 120.44 1.473 . . . . 0.0 108.394 173.464 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 55.6 mt -57.11 -24.39 20.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.546 0 C-N-CA 126.149 1.779 . . . . 0.0 109.213 174.132 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -52.54 -45.34 66.3 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.455 1.102 . . . . 0.0 112.316 175.422 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -63.06 -51.6 66.03 Favored 'General case' 0 N--CA 1.462 0.167 0 CA-C-N 119.364 0.984 . . . . 0.0 109.155 -178.169 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 40.7 tt0 -55.19 -44.76 75.59 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 123.378 0.671 . . . . 0.0 110.469 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 12.6 m -71.58 -29.69 65.0 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.652 0.781 . . . . 0.0 111.423 -179.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 55.7 t80 -69.04 -51.42 39.21 Favored 'General case' 0 CA--C 1.512 -0.5 0 CA-C-N 119.69 1.132 . . . . 0.0 108.09 174.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 82.6 m -54.17 -45.45 72.09 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 124.305 1.042 . . . . 0.0 109.39 176.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -62.79 -47.72 82.27 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.043 0.838 . . . . 0.0 110.813 179.002 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 23.2 t -67.59 -43.73 79.82 Favored 'General case' 0 N--CA 1.447 -0.619 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.8 tt -54.94 -52.52 62.71 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 123.991 0.917 . . . . 0.0 108.574 174.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -58.55 -45.11 89.63 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 123.963 0.905 . . . . 0.0 110.681 179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . 0.436 ' NE2' ' HE2' ' A' ' 447' ' ' LYS . 7.3 t60 -69.42 -35.04 75.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 119.414 1.006 . . . . 0.0 110.688 -179.004 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.45 -56.05 24.71 Favored 'General case' 0 C--O 1.225 -0.228 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 173.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.699 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 10.7 m-85 -61.97 -48.34 80.8 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 123.931 0.893 . . . . 0.0 110.474 -176.14 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -55.67 -42.13 74.68 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 127.035 2.134 . . . . 0.0 111.787 176.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 7.8 t -67.08 -39.49 86.83 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.49 0.716 . . . . 0.0 111.764 174.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 41.8 mt -68.23 -38.37 81.8 Favored 'General case' 0 N--CA 1.464 0.263 0 O-C-N 121.434 -0.791 . . . . 0.0 109.908 178.616 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.03 -46.35 88.43 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 125.838 1.655 . . . . 0.0 109.001 173.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -64.2 -43.25 95.61 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.405 0.682 . . . . 0.0 111.131 178.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 40.8 mt -61.84 -49.22 77.14 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 120.948 -1.095 . . . . 0.0 111.203 174.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 38.4 ttt-85 -57.8 -40.41 79.86 Favored 'General case' 0 CA--C 1.52 -0.189 0 C-N-CA 124.456 1.102 . . . . 0.0 109.668 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 3.5 tt0 -56.09 -49.21 74.47 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 118.185 -0.912 . . . . 0.0 110.248 174.01 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 14.3 tt0 -66.88 -36.98 83.55 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 120.048 1.295 . . . . 0.0 111.41 -175.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -55.19 -52.36 63.58 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 125.209 1.404 . . . . 0.0 109.766 174.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.474 ' HB3' HD11 ' A' ' 571' ' ' LEU . 13.8 mt -60.86 -55.42 33.22 Favored 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 124.11 0.964 . . . . 0.0 110.332 177.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.443 ' CD1' HD13 ' A' ' 571' ' ' LEU . 26.5 mm -63.61 -31.81 54.41 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 O-C-N 121.726 -0.609 . . . . 0.0 109.972 -174.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -63.04 -40.36 97.5 Favored 'General case' 0 N--CA 1.452 -0.329 0 CA-C-N 119.306 0.957 . . . . 0.0 109.927 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 39.3 mtt85 -69.06 -23.83 64.09 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 116.368 -1.777 . . . . 0.0 110.968 173.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -70.08 -41.0 74.67 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 122.795 2.543 . . . . 0.0 109.863 179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -75.91 5.1 6.94 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -174.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.8 OUTLIER -148.18 -79.98 0.14 Allowed 'General case' 0 N--CA 1.454 -0.238 0 CA-C-N 119.176 0.898 . . . . 0.0 109.633 175.093 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.48 ' H ' HG23 ' A' ' 560' ' ' THR . 5.8 t-80 -47.39 -48.12 26.17 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 127.666 2.386 . . . . 0.0 113.662 -173.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 84.99 87.53 0.91 Allowed Glycine 0 CA--C 1.523 0.567 0 N-CA-C 107.929 -2.068 . . . . 0.0 107.929 -173.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -73.3 172.52 11.03 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 109.025 -0.731 . . . . 0.0 109.025 173.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -64.78 158.7 24.18 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 123.268 0.627 . . . . 0.0 110.001 -175.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 13.1 m-20 -59.46 -41.14 89.0 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-O 121.317 0.58 . . . . 0.0 109.44 174.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . 0.495 ' CD ' ' H ' ' A' ' 566' ' ' GLU . 23.5 mp0 -57.08 -52.9 63.44 Favored 'General case' 0 N--CA 1.444 -0.754 0 C-N-CA 129.068 2.947 . . . . 0.0 107.784 179.816 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 65.7 mm-40 -62.61 -39.94 95.38 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.554 1.542 . . . . 0.0 111.394 177.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.555 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -69.73 -23.75 63.44 Favored 'General case' 0 CA--C 1.538 0.493 0 O-C-N 120.177 -1.577 . . . . 0.0 110.271 177.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 57.0 mt -84.52 -38.99 19.37 Favored 'General case' 0 C--O 1.224 -0.239 0 C-N-CA 125.145 1.378 . . . . 0.0 110.26 174.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -50.95 -44.49 60.46 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 119.844 1.202 . . . . 0.0 108.619 174.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.555 HD12 ' HA ' ' A' ' 568' ' ' ARG . 17.5 mt -53.55 -40.95 65.96 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.999 0.92 . . . . 0.0 112.874 174.227 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -62.58 -49.99 73.04 Favored 'General case' 0 N--CA 1.453 -0.309 0 CA-C-N 121.102 1.774 . . . . 0.0 109.21 176.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 1.2 m -56.69 -52.96 62.91 Favored 'General case' 0 N--CA 1.453 -0.318 0 O-C-N 124.476 1.11 . . . . 0.0 108.776 -177.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 1.9 tp -52.81 -47.95 67.26 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 125.561 1.545 . . . . 0.0 111.042 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.4 m-80 -60.23 -37.82 81.52 Favored 'General case' 0 N--CA 1.464 0.266 0 C-N-CA 123.711 0.804 . . . . 0.0 112.31 -178.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 82.7 mm-40 -80.03 -35.74 36.8 Favored 'General case' 0 N--CA 1.458 -0.051 0 CA-C-O 118.281 -0.866 . . . . 0.0 110.426 179.264 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -67.76 -31.89 72.1 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 123.566 0.746 . . . . 0.0 109.9 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 32.1 mt -80.73 -15.14 57.26 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.071 0.948 . . . . 0.0 110.638 178.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 41.44 48.92 3.43 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 126.985 2.114 . . . . 0.0 112.133 179.577 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 25.3 mttt -129.99 169.25 15.49 Favored 'General case' 0 C--O 1.235 0.322 0 C-N-CA 124.283 1.033 . . . . 0.0 109.884 -174.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 80.7 tttt . . . . . 0 C--O 1.235 0.303 0 C-N-CA 124.335 1.054 . . . . 0.0 108.668 -179.607 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.453 -0.291 0 N-CA-C 109.253 -0.647 . . . . 0.0 109.253 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -61.42 138.37 58.26 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.452 1.095 . . . . 0.0 110.357 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . 0.732 HG21 ' CG ' ' A' ' 541' ' ' HIS . 92.6 m 65.62 123.39 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.407 1.067 . . . . 0.0 110.403 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 97.7 m -155.97 162.29 40.38 Favored 'General case' 0 C--N 1.324 -0.513 0 O-C-N 124.568 1.168 . . . . 0.0 110.417 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptm -55.0 -17.62 4.0 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.604 1.19 . . . . 0.0 111.037 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 23.5 mtt85 -74.9 -21.99 58.89 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.535 1.147 . . . . 0.0 110.34 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.504 HD13 ' HA ' ' A' ' 453' ' ' ILE . 1.8 mm -75.14 -45.43 41.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 O-C-N 124.506 1.129 . . . . 0.0 109.346 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.536 HD12 ' CZ ' ' A' ' 485' ' ' PHE . 4.1 mm? -59.14 -47.23 86.06 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.578 1.174 . . . . 0.0 109.298 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.578 HG22 HD13 ' A' ' 519' ' ' LEU . 24.3 mt -72.79 -54.25 16.52 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 O-C-N 124.514 1.134 . . . . 0.0 109.265 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -45.46 -49.27 11.36 Favored Glycine 0 CA--C 1.529 0.965 0 O-C-N 124.552 1.157 . . . . 0.0 111.005 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.726 HD11 HG22 ' A' ' 534' ' ' THR . 38.3 mt -66.1 -42.7 88.9 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.452 0.737 . . . . 0.0 109.33 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.482 HD21 ' HB2' ' A' ' 465' ' ' ALA . 1.9 tm? -64.81 -26.91 68.55 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.517 1.136 . . . . 0.0 109.372 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.494 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 3.6 t -69.56 -52.56 31.09 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 O-C-N 124.446 1.091 . . . . 0.0 109.342 179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . 0.407 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 4.4 mt-30 -75.49 -27.45 58.81 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.477 1.11 . . . . 0.0 110.23 -179.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.739 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.3 OUTLIER -129.6 90.04 45.01 Favored Pre-proline 0 C--N 1.325 -0.495 0 O-C-N 124.513 1.133 . . . . 0.0 109.269 179.999 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.05 -13.81 21.2 Favored 'Trans proline' 0 C--N 1.359 1.111 0 O-C-N 124.451 1.764 . . . . 0.0 111.028 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -77.11 -9.41 58.72 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.497 1.123 . . . . 0.0 110.311 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.766 HD22 ' CD2' ' A' ' 535' ' ' PHE . 18.7 mt -75.7 -15.16 60.33 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.443 1.089 . . . . 0.0 109.269 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.645 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -62.01 -31.53 71.92 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 124.517 1.136 . . . . 0.0 109.342 180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 2.6 m -76.72 -13.22 60.06 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 124.53 1.144 . . . . 0.0 110.344 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.689 HD12 HD23 ' A' ' 464' ' ' LEU . 19.5 mt -97.07 -9.12 28.69 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.53 1.144 . . . . 0.0 109.232 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.852 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.5 OUTLIER -97.62 146.43 31.4 Favored Pre-proline 0 C--N 1.324 -0.502 0 O-C-N 124.483 1.114 . . . . 0.0 109.322 -179.976 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.852 ' HD2' HG22 ' A' ' 468' ' ' VAL . 18.3 Cg_endo -75.01 175.29 11.44 Favored 'Trans proline' 0 C--N 1.36 1.161 0 O-C-N 124.457 1.767 . . . . 0.0 111.034 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . 0.429 ' O ' ' HB2' ' A' ' 471' ' ' LEU . 18.5 Cg_endo -74.96 5.29 4.05 Favored 'Trans proline' 0 C--N 1.358 1.075 0 O-C-N 124.488 1.783 . . . . 0.0 111.018 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 1.021 ' CD1' HD12 ' A' ' 474' ' ' LEU . 3.4 mm? 68.63 70.49 0.29 Allowed 'General case' 0 C--N 1.324 -0.521 0 O-C-N 124.484 1.115 . . . . 0.0 109.301 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -100.68 -62.51 1.23 Allowed 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.462 1.101 . . . . 0.0 110.296 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -78.88 -1.39 34.86 Favored 'General case' 0 C--N 1.325 -0.465 0 O-C-N 124.501 1.125 . . . . 0.0 109.319 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 1.021 HD12 ' CD1' ' A' ' 471' ' ' LEU . 7.6 mt -90.88 -61.97 1.55 Allowed 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.606 1.191 . . . . 0.0 109.261 179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 15.8 t0 60.77 152.81 0.02 OUTLIER 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.498 1.124 . . . . 0.0 109.215 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -90.42 15.84 9.92 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.468 1.105 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 13.1 t-20 -111.65 -34.04 6.17 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.49 1.119 . . . . 0.0 109.328 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 10.0 mmtt -81.05 -21.17 40.3 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.438 1.086 . . . . 0.0 109.317 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.458 ' CB ' ' HB2' ' A' ' 482' ' ' LEU . 46.4 mt -126.03 106.03 25.5 Favored Pre-proline 0 C--N 1.325 -0.489 0 O-C-N 124.547 1.154 . . . . 0.0 109.313 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -75.04 73.98 4.17 Favored 'Trans proline' 0 C--N 1.361 1.199 0 O-C-N 124.502 1.79 . . . . 0.0 111.024 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 152.18 -21.38 0.86 Allowed Glycine 0 CA--C 1.53 1.006 0 O-C-N 124.539 1.149 . . . . 0.0 110.895 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.85 ' O ' HD13 ' A' ' 482' ' ' LEU . 2.1 tm? -54.3 -35.82 63.03 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 124.526 0.78 . . . . 0.0 109.336 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.29 -50.97 9.52 Favored Glycine 0 CA--C 1.529 0.942 0 O-C-N 124.508 1.13 . . . . 0.0 111.047 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -54.47 -46.49 73.37 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.447 0.734 . . . . 0.0 109.348 179.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.536 ' CZ ' HD12 ' A' ' 454' ' ' LEU . 46.8 t80 -65.55 -40.35 92.75 Favored 'General case' 0 C--N 1.325 -0.476 0 O-C-N 124.454 1.096 . . . . 0.0 111.035 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.448 ' HB2' ' CD1' ' A' ' 482' ' ' LEU . 2.8 ttt85 -66.52 -49.12 67.56 Favored 'General case' 0 C--N 1.326 -0.447 0 O-C-N 124.511 1.132 . . . . 0.0 110.333 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -56.6 -47.22 80.09 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.495 1.122 . . . . 0.0 110.294 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 1.009 HD11 HD21 ' A' ' 516' ' ' LEU . 1.4 mt -63.42 -49.69 72.74 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.507 1.129 . . . . 0.0 109.279 -180.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.78 HG11 HG11 ' A' ' 468' ' ' VAL . 17.5 t -58.66 -49.75 81.53 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.464 0 O-C-N 124.529 1.143 . . . . 0.0 109.338 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.5 t-20 -53.96 -39.38 65.9 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 124.474 1.109 . . . . 0.0 109.338 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . 0.477 HG23 HE22 ' A' ' 495' ' ' GLN . 1.1 m -73.71 -44.19 57.11 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 124.488 1.117 . . . . 0.0 110.384 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.419 ' HA ' HD22 ' A' ' 498' ' ' LEU . 66.5 m -56.1 -46.43 79.1 Favored 'General case' 0 C--N 1.325 -0.471 0 O-C-N 124.508 1.13 . . . . 0.0 108.227 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.55 -22.19 43.07 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.508 1.13 . . . . 0.0 109.279 -179.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -83.19 -53.25 5.91 Favored 'General case' 0 C--N 1.325 -0.47 0 O-C-N 124.572 1.17 . . . . 0.0 109.998 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.573 ' OE1' ' CD2' ' A' ' 506' ' ' HIS . 2.1 mp0 -61.51 110.99 3.62 Favored Pre-proline 0 C--N 1.324 -0.525 0 O-C-N 124.433 1.083 . . . . 0.0 110.285 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -75.04 126.25 9.83 Favored 'Trans proline' 0 C--N 1.36 1.135 0 O-C-N 124.47 1.774 . . . . 0.0 110.919 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 63.06 41.32 99.84 Favored Glycine 0 CA--C 1.532 1.116 0 O-C-N 124.479 1.112 . . . . 0.0 110.969 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.894 HD21 HD13 ' A' ' 503' ' ' LEU . 43.2 tp -58.46 164.87 2.35 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.54 0.788 . . . . 0.0 109.387 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . 0.408 ' O ' ' HB2' ' A' ' 503' ' ' LEU . 6.3 p -142.95 170.51 15.55 Favored 'General case' 0 C--N 1.325 -0.499 0 O-C-N 124.46 1.1 . . . . 0.0 110.403 -179.992 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.407 ' OG1' ' HA ' ' A' ' 460' ' ' GLN . 2.3 m -66.56 -35.05 79.27 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.44 1.087 . . . . 0.0 110.372 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -83.92 -55.06 2.88 Favored Glycine 0 CA--C 1.53 0.992 0 O-C-N 124.479 1.112 . . . . 0.0 111.033 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 24.8 tp60 -50.81 -29.65 12.2 Favored 'General case' 0 C--N 1.325 -0.457 0 O-C-N 124.459 0.741 . . . . 0.0 110.287 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.894 HD13 HD21 ' A' ' 498' ' ' LEU . 21.9 tp -56.05 -58.81 6.34 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.449 1.093 . . . . 0.0 109.324 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -56.98 -34.57 68.23 Favored 'General case' 0 C--N 1.326 -0.428 0 O-C-N 124.409 1.068 . . . . 0.0 109.357 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -64.32 -34.52 78.34 Favored 'General case' 0 C--N 1.325 -0.486 0 O-C-N 124.453 1.096 . . . . 0.0 110.316 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . 0.573 ' CD2' ' OE1' ' A' ' 495' ' ' GLN . 68.8 t60 -71.69 -13.55 61.77 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.479 1.112 . . . . 0.0 109.538 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.762 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 37.6 m-85 -124.22 27.24 7.15 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.489 1.118 . . . . 0.0 111.071 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.26 126.98 31.21 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.507 1.129 . . . . 0.0 110.352 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 77.12 29.11 57.27 Favored Glycine 0 CA--C 1.529 0.947 0 O-C-N 124.453 1.095 . . . . 0.0 111.002 -179.908 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.852 HG22 ' H ' ' A' ' 512' ' ' ASN . 19.0 m -109.02 136.78 47.97 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.497 0.763 . . . . 0.0 110.373 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 57.4 m-20 -58.75 -15.7 13.32 Favored 'General case' 0 C--N 1.324 -0.504 0 O-C-N 124.533 1.146 . . . . 0.0 109.288 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.852 ' H ' HG22 ' A' ' 510' ' ' THR . 0.6 OUTLIER -97.41 -22.42 16.61 Favored 'General case' 0 C--N 1.324 -0.526 0 O-C-N 124.483 1.115 . . . . 0.0 109.268 179.964 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . 0.762 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.54 -36.08 9.93 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.512 1.132 . . . . 0.0 109.263 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -54.83 -54.49 41.59 Favored 'General case' 0 C--N 1.324 -0.515 0 O-C-N 124.452 1.095 . . . . 0.0 109.291 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 68.6 m -58.32 -42.42 86.7 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 124.461 1.1 . . . . 0.0 110.361 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 1.009 HD21 HD11 ' A' ' 488' ' ' LEU . 13.6 mt -66.56 -33.64 76.13 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.408 1.067 . . . . 0.0 109.335 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 4.5 tt0 -68.21 -47.72 67.12 Favored 'General case' 0 C--N 1.326 -0.443 0 O-C-N 124.477 1.111 . . . . 0.0 110.277 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -56.21 -38.64 71.29 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.533 1.146 . . . . 0.0 109.332 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.578 HD13 HG22 ' A' ' 455' ' ' ILE . 94.5 mt -72.4 -21.73 61.23 Favored 'General case' 0 C--N 1.326 -0.448 0 O-C-N 124.478 1.111 . . . . 0.0 109.31 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 4.9 t -68.74 -59.33 3.18 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.525 1.141 . . . . 0.0 110.071 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . 0.403 ' O ' ' C ' ' A' ' 522' ' ' TRP . 0.3 OUTLIER -77.38 2.18 16.72 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 124.458 1.099 . . . . 0.0 111.009 179.977 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.654 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.9 t90 -42.07 137.67 1.8 Allowed 'General case' 0 C--N 1.324 -0.508 0 O-C-N 124.534 1.146 . . . . 0.0 107.918 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -124.56 1.89 8.28 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.543 1.152 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -66.77 -24.3 66.18 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.488 1.117 . . . . 0.0 109.402 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.654 HD11 ' CE3' ' A' ' 522' ' ' TRP . 0.7 OUTLIER -113.46 -59.81 3.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 O-C-N 124.484 1.115 . . . . 0.0 109.239 -179.989 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.36 61.76 2.09 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.448 1.092 . . . . 0.0 109.31 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . 0.556 ' OD2' HD12 ' A' ' 530' ' ' ILE . 3.7 t70 -161.94 153.21 18.25 Favored 'General case' 0 C--N 1.325 -0.494 0 O-C-N 124.559 1.162 . . . . 0.0 109.325 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.414 ' O ' ' HB3' ' A' ' 531' ' ' ALA . 8.1 pttt -115.93 -36.98 3.98 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 124.609 1.193 . . . . 0.0 109.29 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -76.53 -43.68 38.24 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.426 1.079 . . . . 0.0 109.291 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . 0.556 HD12 ' OD2' ' A' ' 527' ' ' ASP . 55.0 mt -70.91 -12.39 16.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 O-C-N 124.461 1.101 . . . . 0.0 109.345 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 457' ' ' LEU . . . -61.36 -58.19 9.24 Favored 'General case' 0 C--N 1.325 -0.464 0 O-C-N 124.44 1.088 . . . . 0.0 109.295 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -53.47 -48.07 69.2 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.411 1.069 . . . . 0.0 110.299 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.39 -43.63 93.85 Favored 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.459 1.1 . . . . 0.0 110.304 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . 0.726 HG22 HD11 ' A' ' 457' ' ' LEU . 3.7 m -66.47 -36.08 81.87 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.429 1.08 . . . . 0.0 110.4 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.766 ' CD2' HD22 ' A' ' 464' ' ' LEU . 18.9 t80 -61.51 -51.6 67.96 Favored 'General case' 0 C--N 1.324 -0.505 0 O-C-N 124.565 1.166 . . . . 0.0 111.033 -179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 53.8 m -64.61 -46.91 80.6 Favored 'General case' 0 C--N 1.326 -0.433 0 O-C-N 124.517 1.136 . . . . 0.0 110.345 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -58.37 -41.18 84.22 Favored 'General case' 0 C--N 1.324 -0.503 0 O-C-N 124.533 1.145 . . . . 0.0 109.286 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 5.7 t -69.8 -56.49 7.0 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 124.495 1.122 . . . . 0.0 109.992 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.611 HD11 HG23 ' A' ' 468' ' ' VAL . 0.7 OUTLIER -48.36 -43.54 33.7 Favored 'General case' 0 C--N 1.324 -0.527 0 O-C-N 124.483 1.114 . . . . 0.0 109.268 -179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -64.14 -38.26 90.42 Favored 'General case' 0 C--N 1.326 -0.453 0 O-C-N 124.496 1.122 . . . . 0.0 109.321 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . 0.732 ' CG ' HG21 ' A' ' 449' ' ' THR . 8.6 t-80 -62.71 -46.6 87.34 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.558 1.161 . . . . 0.0 109.601 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . 0.412 ' O ' ' HG ' ' A' ' 546' ' ' LEU . 1.1 ttp -63.48 -44.9 93.08 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.478 1.111 . . . . 0.0 111.04 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.909 ' HA ' HD12 ' A' ' 546' ' ' LEU . 5.8 m-85 -68.84 -35.13 76.57 Favored 'General case' 0 C--N 1.325 -0.459 0 O-C-N 124.526 1.141 . . . . 0.0 111.001 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -66.01 -44.85 83.56 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.52 1.138 . . . . 0.0 109.258 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 1.2 t -52.98 -37.65 61.46 Favored 'General case' 0 C--N 1.325 -0.483 0 O-C-N 124.489 1.118 . . . . 0.0 109.994 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.909 HD12 ' HA ' ' A' ' 543' ' ' PHE . 1.2 mt -72.11 -50.58 26.9 Favored 'General case' 0 C--N 1.325 -0.487 0 O-C-N 124.486 1.116 . . . . 0.0 109.234 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.409 HD22 HD11 ' A' ' 574' ' ' LEU . 79.1 mt -53.53 -36.15 61.47 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.542 1.151 . . . . 0.0 109.233 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 14.8 tt0 -59.02 -55.33 36.55 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 124.489 1.118 . . . . 0.0 110.316 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 5.9 mp -63.8 -44.12 94.28 Favored 'General case' 0 C--N 1.325 -0.479 0 O-C-N 124.531 1.145 . . . . 0.0 109.304 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -51.44 -48.85 62.59 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 124.527 1.142 . . . . 0.0 110.378 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . 0.543 ' HG3' HD23 ' A' ' 571' ' ' LEU . 27.1 tt0 -52.44 -45.7 66.11 Favored 'General case' 0 C--N 1.326 -0.436 0 O-C-N 124.528 1.142 . . . . 0.0 110.338 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -63.94 -47.76 79.2 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.548 1.155 . . . . 0.0 110.306 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -61.11 -33.74 73.86 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 124.534 1.146 . . . . 0.0 110.223 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.849 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.4 OUTLIER -69.87 -50.28 44.05 Favored 'General case' 0 C--N 1.325 -0.485 0 O-C-N 124.471 1.107 . . . . 0.0 109.216 -179.962 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.906 HD13 HD13 ' A' ' 571' ' ' LEU . 28.0 mm -64.25 -30.6 50.55 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.554 0 O-C-N 124.523 1.139 . . . . 0.0 109.248 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.458 ' O ' ' CG2' ' A' ' 560' ' ' THR . . . -57.14 -19.28 19.23 Favored 'General case' 0 C--N 1.326 -0.452 0 O-C-N 124.488 1.117 . . . . 0.0 109.346 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . 0.631 ' C ' HD23 ' A' ' 563' ' ' LEU . 7.8 mmt85 -104.44 3.43 32.17 Favored 'General case' 0 C--N 1.325 -0.462 0 O-C-N 124.546 1.154 . . . . 0.0 110.293 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . 0.587 ' HB2' HD21 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -104.86 -21.45 13.33 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 124.474 1.109 . . . . 0.0 110.298 179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.4 ttm180 -108.83 7.62 26.26 Favored 'General case' 0 C--N 1.323 -0.545 0 O-C-N 124.609 1.193 . . . . 0.0 110.203 -179.84 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.458 ' CG2' ' O ' ' A' ' 556' ' ' ALA . 16.9 p -114.01 -61.71 1.7 Allowed 'General case' 0 C--N 1.326 -0.441 0 O-C-N 124.48 1.113 . . . . 0.0 110.362 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -118.93 -41.55 2.76 Favored 'General case' 0 C--N 1.325 -0.481 0 O-C-N 124.469 1.105 . . . . 0.0 109.567 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . 0.423 ' HA2' ' HA ' ' A' ' 558' ' ' GLU . . . 105.48 93.5 2.31 Favored Glycine 0 CA--C 1.53 1.026 0 O-C-N 124.508 1.13 . . . . 0.0 111.028 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.631 HD23 ' C ' ' A' ' 557' ' ' ARG . 0.2 OUTLIER -55.83 -174.5 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.489 0 O-C-N 124.504 0.767 . . . . 0.0 109.265 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.37 145.85 55.64 Favored 'General case' 0 C--N 1.325 -0.469 0 O-C-N 124.476 1.11 . . . . 0.0 110.061 179.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.754 ' O ' HD13 ' A' ' 569' ' ' LEU . 0.8 OUTLIER -52.94 -38.73 62.28 Favored 'General case' 0 C--N 1.324 -0.525 0 O-C-N 124.504 1.128 . . . . 0.0 109.265 -179.961 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.51 -42.49 78.46 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 124.462 1.101 . . . . 0.0 110.312 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . 0.508 ' CB ' HD12 ' A' ' 563' ' ' LEU . 46.9 mm-40 -67.67 -41.16 84.15 Favored 'General case' 0 C--N 1.325 -0.475 0 O-C-N 124.557 1.161 . . . . 0.0 110.228 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.485 ' CG ' ' OE2' ' A' ' 558' ' ' GLU . 0.7 OUTLIER -60.56 -36.49 78.61 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 124.518 1.136 . . . . 0.0 110.217 -179.904 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.754 HD13 ' O ' ' A' ' 565' ' ' ASN . 7.6 mp -71.58 -37.62 70.99 Favored 'General case' 0 C--N 1.326 -0.449 0 O-C-N 124.493 1.12 . . . . 0.0 109.3 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 13.3 tp10 -51.58 -37.65 50.76 Favored 'General case' 0 C--N 1.325 -0.477 0 O-C-N 124.433 1.083 . . . . 0.0 110.367 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.906 HD13 HD13 ' A' ' 555' ' ' ILE . 2.7 mt -60.21 -51.01 71.38 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.435 1.085 . . . . 0.0 109.29 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.603 ' CD2' ' N ' ' A' ' 573' ' ' THR . 0.0 OUTLIER -51.44 -57.55 8.68 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 124.503 1.127 . . . . 0.0 108.052 -179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.603 ' N ' ' CD2' ' A' ' 572' ' ' TRP . 1.4 m -55.12 -32.78 62.33 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 124.569 1.168 . . . . 0.0 110.421 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.409 HD11 HD22 ' A' ' 547' ' ' LEU . 1.5 tp -70.95 -41.41 71.13 Favored 'General case' 0 C--N 1.325 -0.492 0 O-C-N 124.493 1.121 . . . . 0.0 109.359 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 7.6 m-80 -59.6 -33.52 71.58 Favored 'General case' 0 C--N 1.326 -0.456 0 O-C-N 124.473 1.108 . . . . 0.0 109.235 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -67.16 -22.5 65.76 Favored 'General case' 0 C--N 1.325 -0.488 0 O-C-N 124.467 1.104 . . . . 0.0 110.334 -179.964 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.27 -27.63 24.28 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 124.586 1.179 . . . . 0.0 110.369 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.4 ' O ' ' C ' ' A' ' 579' ' ' ALA . 1.9 mt -87.03 -6.73 58.63 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 124.488 1.118 . . . . 0.0 109.341 179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . 0.4 ' C ' ' O ' ' A' ' 578' ' ' LEU . . . -40.53 -65.47 0.41 Allowed 'General case' 0 C--N 1.324 -0.502 0 O-C-N 124.546 1.154 . . . . 0.0 109.293 -179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -154.34 73.51 0.92 Allowed 'General case' 0 C--N 1.325 -0.49 0 O-C-N 124.531 1.144 . . . . 0.0 109.378 179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--N 1.326 -0.433 0 O-C-N 124.472 1.108 . . . . 0.0 109.329 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.5 pttt . . . . . 0 C--O 1.22 -0.459 0 N-CA-C 114.251 1.204 . . . . 0.0 114.251 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? 53.59 -88.65 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.351 1.46 . . . . 0.0 109.466 -173.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 3.7 t -83.25 172.42 12.6 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 120.347 1.43 . . . . 0.0 109.619 178.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 3.0 t -161.21 58.06 0.29 Allowed 'General case' 0 N--CA 1.438 -1.026 0 C-N-CA 125.681 1.592 . . . . 0.0 107.663 173.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 44.95 47.02 9.33 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 124.893 1.277 . . . . 0.0 110.08 -173.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.76 -46.28 0.87 Allowed 'General case' 0 CA--C 1.51 -0.59 0 CA-C-O 118.418 -0.801 . . . . 0.0 110.024 -178.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.492 HD12 HG23 ' A' ' 525' ' ' ILE . 18.7 mm -57.18 -52.4 56.86 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 C-N-CA 124.305 1.042 . . . . 0.0 108.247 176.71 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 7.0 mt -51.74 -42.61 62.45 Favored 'General case' 0 C--O 1.219 -0.518 0 CA-C-O 117.835 -1.079 . . . . 0.0 111.413 177.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.566 HD13 HD23 ' A' ' 484' ' ' LEU . 92.9 mt -65.43 -62.68 1.12 Allowed 'Isoleucine or valine' 0 C--O 1.221 -0.402 0 CA-C-N 119.614 1.097 . . . . 0.0 109.945 174.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -57.12 -40.59 91.76 Favored Glycine 0 C--N 1.337 0.587 0 CA-C-N 120.073 1.306 . . . . 0.0 113.58 -173.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.704 HD21 HG21 ' A' ' 525' ' ' ILE . 26.2 mt -67.42 -45.53 75.84 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -63.0 -33.83 76.25 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-N 119.153 0.888 . . . . 0.0 110.458 176.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.527 HG13 HD23 ' A' ' 503' ' ' LEU . 25.5 t -62.89 -51.52 70.96 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.489 -0.757 . . . . 0.0 109.394 176.675 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.2 mt-30 -74.41 -14.92 60.92 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 115.617 -0.719 . . . . 0.0 112.743 -179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 48.7 t-20 -144.81 77.42 13.42 Favored Pre-proline 0 CA--C 1.539 0.52 0 C-N-CA 126.961 2.104 . . . . 0.0 109.165 -174.108 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 30.3 Cg_endo -69.6 -13.75 35.54 Favored 'Trans proline' 0 N--CA 1.457 -0.628 0 C-N-CA 122.256 1.971 . . . . 0.0 111.688 -176.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 42.2 mt-10 -69.64 -23.07 63.43 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.701 1.601 . . . . 0.0 110.224 174.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.507 HD23 HD12 ' A' ' 467' ' ' LEU . 56.1 mt -58.77 -18.13 29.2 Favored 'General case' 0 N--CA 1.475 0.798 0 CA-C-N 119.79 1.177 . . . . 0.0 111.022 173.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.486 ' CB ' HG13 ' A' ' 489' ' ' VAL . . . -63.3 -19.63 64.77 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.268 -0.895 . . . . 0.0 111.989 173.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 24.0 m -83.67 -18.71 37.11 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.879 0.872 . . . . 0.0 110.929 174.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.507 HD12 HD23 ' A' ' 464' ' ' LEU . 81.9 mt -95.32 -19.15 20.2 Favored 'General case' 0 C--N 1.34 0.177 0 CA-C-O 118.504 -0.76 . . . . 0.0 111.673 176.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 489' ' ' VAL . 0.8 OUTLIER -72.01 150.27 92.53 Favored Pre-proline 0 CA--C 1.552 1.055 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 177.332 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 468' ' ' VAL . 14.2 Cg_endo -74.69 172.92 15.28 Favored 'Trans proline' 0 CA--C 1.537 0.661 0 C-N-CA 123.958 3.106 . . . . 0.0 112.021 174.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 46.3 Cg_endo -72.32 13.2 0.56 Allowed 'Trans proline' 0 CA--C 1.547 1.146 0 C-N-CA 123.117 2.545 . . . . 0.0 114.339 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.642 HD13 HD12 ' A' ' 474' ' ' LEU . 2.6 mm? 61.79 60.59 1.56 Allowed 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 127.262 2.225 . . . . 0.0 112.39 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -90.55 -68.88 0.76 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.353 1.061 . . . . 0.0 109.911 174.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -71.13 -0.55 9.91 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.632 1.345 . . . . 0.0 114.632 179.366 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.642 HD12 HD13 ' A' ' 471' ' ' LEU . 17.7 mt -100.99 -81.72 0.47 Allowed 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 124.23 1.012 . . . . 0.0 110.473 -175.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 45.1 t0 62.95 153.28 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.126 1.77 . . . . 0.0 112.37 -174.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -75.49 -22.89 56.81 Favored 'General case' 0 CA--C 1.532 0.287 0 O-C-N 120.696 -1.253 . . . . 0.0 109.484 174.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -52.15 -46.57 65.48 Favored 'General case' 0 C--N 1.339 0.151 0 C-N-CA 125.483 1.513 . . . . 0.0 110.674 174.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -83.07 -29.9 28.43 Favored 'General case' 0 C--N 1.347 0.5 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 178.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . . . . . . . . . 47.0 mt -128.1 98.5 26.78 Favored Pre-proline 0 C--O 1.232 0.167 0 CA-C-N 119.698 1.136 . . . . 0.0 109.738 -173.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo -68.46 -22.67 38.62 Favored 'Trans proline' 0 N--CA 1.457 -0.622 0 C-N-CA 122.262 1.975 . . . . 0.0 112.328 -173.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -89.62 -13.95 60.5 Favored Glycine 0 CA--C 1.525 0.716 0 CA-C-O 118.805 -0.997 . . . . 0.0 112.291 174.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.9 tt -69.74 -25.56 63.89 Favored 'General case' 0 C--O 1.217 -0.616 0 CA-C-N 118.972 1.386 . . . . 0.0 110.233 175.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.67 -47.01 13.18 Favored Glycine 0 CA--C 1.526 0.735 0 CA-C-N 119.382 0.992 . . . . 0.0 111.944 173.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 0.566 HD23 HD13 ' A' ' 455' ' ' ILE . 39.8 tp -60.36 -49.56 77.1 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 117.734 0.767 . . . . 0.0 110.921 174.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 42.3 t80 -57.66 -51.28 70.18 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 119.567 1.076 . . . . 0.0 111.457 178.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 8.6 ttt-85 -54.17 -52.77 60.11 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.044 0.937 . . . . 0.0 109.655 176.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -61.87 -43.75 98.21 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.755 0.707 . . . . 0.0 110.356 -174.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.44 HD11 HD21 ' A' ' 516' ' ' LEU . 2.3 mp -54.99 -56.49 19.1 Favored 'General case' 0 C--O 1.22 -0.453 0 C-N-CA 124.798 1.239 . . . . 0.0 108.89 175.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.963 HG11 HG11 ' A' ' 468' ' ' VAL . 75.6 t -57.25 -47.55 84.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 CA-C-N 118.601 0.637 . . . . 0.0 109.78 178.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -57.09 -40.94 77.92 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 119.477 1.035 . . . . 0.0 109.856 -176.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 13.2 m -69.27 -39.77 78.18 Favored 'General case' 0 N--CA 1.446 -0.644 0 C-N-CA 125.226 1.411 . . . . 0.0 111.204 173.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.561 ' HA ' HD22 ' A' ' 498' ' ' LEU . 99.5 m -62.17 -40.71 96.94 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 120.047 1.294 . . . . 0.0 110.472 176.051 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.03 -24.55 66.02 Favored 'General case' 0 CA--C 1.529 0.16 0 C-N-CA 125.313 1.445 . . . . 0.0 111.113 175.74 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 7.1 t -79.8 -53.41 6.82 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.808 0.843 . . . . 0.0 110.599 175.207 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 19.7 mm100 -68.9 104.64 0.77 Allowed Pre-proline 0 CA--C 1.539 0.544 0 C-N-CA 125.516 1.526 . . . . 0.0 110.018 -174.186 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -70.23 125.68 12.17 Favored 'Trans proline' 0 N--CA 1.451 -1.028 0 C-N-CA 122.261 1.974 . . . . 0.0 109.582 -175.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 64.34 36.15 92.85 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 112.195 -0.362 . . . . 0.0 112.195 -178.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.561 HD22 ' HA ' ' A' ' 492' ' ' CYS . 20.3 tp -57.1 156.21 7.41 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-O 121.653 0.739 . . . . 0.0 109.647 173.952 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 3.4 p -142.66 168.17 20.35 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 125.336 1.454 . . . . 0.0 108.193 -178.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -52.3 -46.23 65.85 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 124.049 0.94 . . . . 0.0 110.738 174.336 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -76.69 -43.96 16.99 Favored Glycine 0 CA--C 1.526 0.754 0 N-CA-C 110.347 -1.101 . . . . 0.0 110.347 -175.547 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 70.8 tp60 -62.32 -27.82 69.31 Favored 'General case' 0 CA--C 1.529 0.164 0 C-N-CA 124.4 1.08 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.527 HD23 HG13 ' A' ' 459' ' ' VAL . 61.4 tp -59.03 -57.0 15.04 Favored 'General case' 0 CA--C 1.52 -0.211 0 C-N-CA 124.192 0.997 . . . . 0.0 108.506 176.256 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.659 HD21 ' HA ' ' A' ' 517' ' ' GLU . 11.2 mp -62.44 -31.54 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 118.369 -0.824 . . . . 0.0 110.535 177.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.9 tt0 -63.37 -44.69 94.07 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.35 0.977 . . . . 0.0 110.657 176.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 70.0 t60 -63.88 -15.13 58.27 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.53 1.132 . . . . 0.0 111.887 175.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 55.9 m-85 -116.23 21.61 13.51 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.982 1.313 . . . . 0.0 110.129 178.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.0 ttt85 -57.26 123.0 13.82 Favored 'General case' 0 C--O 1.227 -0.111 0 O-C-N 120.153 -1.592 . . . . 0.0 110.6 -176.131 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 72.83 31.71 62.0 Favored Glycine 0 CA--C 1.532 1.13 0 CA-C-O 119.5 -0.611 . . . . 0.0 113.592 177.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.839 HG22 ' H ' ' A' ' 512' ' ' ASN . 38.7 m -101.6 148.54 25.1 Favored 'General case' 0 C--N 1.333 -0.145 0 C-N-CA 125.643 1.577 . . . . 0.0 110.073 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -60.24 -15.71 27.15 Favored 'General case' 0 N--CA 1.474 0.73 0 O-C-N 121.613 -0.679 . . . . 0.0 112.754 174.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.839 ' H ' HG22 ' A' ' 510' ' ' THR . 2.0 m-20 -101.83 -21.46 14.58 Favored 'General case' 0 C--N 1.344 0.339 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 -177.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -44.86 -48.19 11.11 Favored 'General case' 0 C--O 1.21 -1.025 0 CA-C-N 119.959 1.254 . . . . 0.0 110.101 174.516 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.94 -43.82 81.91 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 119.766 1.167 . . . . 0.0 111.972 -177.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 54.1 m -63.21 -53.06 59.04 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 174.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.44 HD21 HD11 ' A' ' 488' ' ' LEU . 54.2 mt -55.14 -39.71 69.76 Favored 'General case' 0 C--O 1.219 -0.551 0 C-N-CA 124.525 1.13 . . . . 0.0 110.552 -179.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.659 ' HA ' HD21 ' A' ' 504' ' ' LEU . 9.9 tt0 -68.87 -46.12 69.26 Favored 'General case' 0 N--CA 1.467 0.376 0 C-N-CA 127.671 2.388 . . . . 0.0 110.234 179.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 1.9 tttm -56.8 -42.92 80.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 108.917 -0.772 . . . . 0.0 108.917 173.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.517 HD13 HG22 ' A' ' 455' ' ' ILE . 90.5 mt -78.4 -14.37 59.42 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 117.999 -1.0 . . . . 0.0 112.378 179.339 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 3.1 t -73.03 -28.48 62.37 Favored 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 124.41 1.084 . . . . 0.0 110.432 174.068 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.09 -2.15 21.31 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.095 1.358 . . . . 0.0 112.61 177.09 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.563 ' CE3' HD11 ' A' ' 525' ' ' ILE . 24.3 t90 -70.96 83.55 0.67 Allowed 'General case' 0 N--CA 1.456 -0.139 0 C-N-CA 123.8 0.84 . . . . 0.0 109.621 -178.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -88.37 -1.39 58.01 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 127.311 2.245 . . . . 0.0 111.312 177.748 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -76.18 51.23 0.67 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.481 2.313 . . . . 0.0 109.878 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.704 HG21 HD21 ' A' ' 457' ' ' LEU . 55.0 mt -135.85 -71.37 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.584 0 C-N-CA 127.408 2.283 . . . . 0.0 107.542 -173.752 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -170.67 -89.87 0.01 OUTLIER 'General case' 0 C--N 1.351 0.633 0 C-N-CA 125.968 1.707 . . . . 0.0 110.755 -178.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -164.8 164.54 21.06 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 129.897 3.279 . . . . 0.0 107.717 -176.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 10.6 ttmm -62.27 -26.88 68.64 Favored 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.306 1.442 . . . . 0.0 110.331 173.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -78.41 -60.57 2.32 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 119.774 1.17 . . . . 0.0 110.386 178.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 75.9 mt -59.87 -20.9 20.36 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.404 0 C-N-CA 124.528 1.131 . . . . 0.0 110.638 177.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.503 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -50.44 -43.16 54.94 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-O 117.304 -1.331 . . . . 0.0 110.233 174.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 12.7 tp10 -58.34 -48.32 80.93 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.502 1.501 . . . . 0.0 110.098 179.752 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.22 -47.16 77.79 Favored 'General case' 0 CA--C 1.534 0.342 0 O-C-N 121.183 -0.948 . . . . 0.0 110.671 -179.626 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 87.4 m -63.94 -26.44 68.59 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.159 1.384 . . . . 0.0 111.717 177.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.486 ' CD1' HD13 ' A' ' 464' ' ' LEU . 88.9 t80 -72.21 -52.98 14.0 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 119.855 1.207 . . . . 0.0 108.68 176.457 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 23.1 m -61.86 -40.44 95.34 Favored 'General case' 0 N--CA 1.446 -0.674 0 O-C-N 123.788 0.68 . . . . 0.0 110.285 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 20.8 t0 -61.02 -43.9 98.21 Favored 'General case' 0 N--CA 1.478 0.943 0 CA-C-N 119.725 1.148 . . . . 0.0 110.847 174.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 18.0 t -64.6 -48.32 75.38 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 124.977 1.311 . . . . 0.0 111.895 176.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 1.1 tt -55.19 -52.03 64.66 Favored 'General case' 0 C--O 1.242 0.663 0 CA-C-O 118.019 -0.991 . . . . 0.0 108.535 175.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -57.46 -41.02 79.76 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 123.933 0.893 . . . . 0.0 111.328 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.2 t60 -63.18 -38.99 93.33 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.144 0.429 . . . . 0.0 110.728 178.135 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -66.11 -51.28 59.42 Favored 'General case' 0 C--O 1.222 -0.343 0 O-C-N 121.595 -0.691 . . . . 0.0 109.704 176.422 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CE1' HD11 ' A' ' 474' ' ' LEU . 12.4 m-85 -57.77 -46.94 83.85 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 123.586 0.754 . . . . 0.0 110.745 179.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -54.99 -50.88 67.88 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 126.868 2.067 . . . . 0.0 110.025 173.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 12.3 t -53.66 -47.83 70.02 Favored 'General case' 0 C--O 1.217 -0.627 0 C-N-CA 123.389 0.676 . . . . 0.0 109.878 176.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.444 ' CD1' HD23 ' A' ' 474' ' ' LEU . 60.7 mt -67.16 -42.34 84.49 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 119.292 0.951 . . . . 0.0 110.638 -175.455 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 38.2 mt -65.49 -38.14 88.88 Favored 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 123.976 0.911 . . . . 0.0 110.158 176.828 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.07 -52.22 37.65 Favored 'General case' 0 CA--C 1.52 -0.192 0 C-N-CA 126.03 1.732 . . . . 0.0 110.003 178.048 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 31.7 mt -52.49 -50.57 62.5 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 125.259 1.423 . . . . 0.0 107.932 173.848 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.89 -40.21 94.66 Favored 'General case' 0 N--CA 1.467 0.408 0 O-C-N 120.691 -1.255 . . . . 0.0 111.449 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -60.01 -48.63 80.93 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-N 119.441 1.019 . . . . 0.0 108.329 175.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.75 -42.08 95.44 Favored 'General case' 0 C--O 1.219 -0.523 0 C-N-CA 123.518 0.727 . . . . 0.0 110.331 -176.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.16 -42.06 94.09 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 126.005 1.722 . . . . 0.0 110.282 -178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 571' ' ' LEU . 0.3 OUTLIER -73.03 -30.85 64.05 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-O 118.55 -0.738 . . . . 0.0 109.367 177.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.489 HD11 HD13 ' A' ' 571' ' ' LEU . 12.1 mm -76.18 -31.98 22.01 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 CA-C-N 120.127 1.33 . . . . 0.0 110.341 174.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.89 -29.99 70.57 Favored 'General case' 0 N--CA 1.448 -0.537 0 C-N-CA 125.469 1.507 . . . . 0.0 108.094 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 7.4 ptm180 -90.58 15.37 11.01 Favored 'General case' 0 C--O 1.223 -0.301 0 C-N-CA 125.328 1.451 . . . . 0.0 109.417 176.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -97.82 -50.58 4.38 Favored 'General case' 0 N--CA 1.48 1.037 0 CA-C-N 122.186 2.267 . . . . 0.0 109.674 174.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.83 -0.24 12.87 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 125.033 1.333 . . . . 0.0 113.537 -174.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.747 HG23 ' H ' ' A' ' 561' ' ' HIS . 0.0 OUTLIER -131.89 -81.44 0.51 Allowed 'General case' 0 C--O 1.236 0.358 0 C-N-CA 127.819 2.447 . . . . 0.0 108.984 179.385 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.747 ' H ' HG23 ' A' ' 560' ' ' THR . 0.1 OUTLIER -56.12 -77.18 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 127.549 2.34 . . . . 0.0 106.605 -174.14 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 136.42 124.58 2.37 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 125.346 1.451 . . . . 0.0 110.027 175.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.466 HD22 ' HB3' ' A' ' 567' ' ' GLU . 10.4 mt -75.83 176.92 7.35 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 178.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -109.18 175.15 5.56 Favored 'General case' 0 C--N 1.345 0.378 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.383 173.553 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -63.72 -42.31 97.94 Favored 'General case' 0 N--CA 1.446 -0.65 0 N-CA-C 108.068 -1.086 . . . . 0.0 108.068 174.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -77.47 -51.0 11.47 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.913 0.758 . . . . 0.0 108.977 -174.198 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . 0.466 ' HB3' HD22 ' A' ' 563' ' ' LEU . 2.9 mp0 -59.16 -31.23 68.79 Favored 'General case' 0 N--CA 1.464 0.231 0 O-C-N 120.601 -1.312 . . . . 0.0 112.624 177.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.48 ' HA ' HD12 ' A' ' 571' ' ' LEU . 0.0 OUTLIER -70.81 -33.28 70.55 Favored 'General case' 0 CA--C 1.536 0.43 0 O-C-N 120.997 -1.065 . . . . 0.0 109.735 174.785 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 42.3 mt -68.57 -37.83 80.2 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-O 117.74 -1.124 . . . . 0.0 109.251 176.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -46.45 -41.52 14.02 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 119.983 1.265 . . . . 0.0 109.931 173.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.61 HD11 HD11 ' A' ' 554' ' ' LEU . 3.0 mt -62.42 -40.81 97.76 Favored 'General case' 0 N--CA 1.472 0.639 0 O-C-N 120.737 -1.227 . . . . 0.0 113.585 177.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -59.45 -45.54 91.32 Favored 'General case' 0 N--CA 1.442 -0.867 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -66.82 -30.55 70.76 Favored 'General case' 0 CA--C 1.543 0.705 0 O-C-N 123.773 0.67 . . . . 0.0 110.305 -177.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -74.7 -36.24 62.74 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 125.39 1.476 . . . . 0.0 111.312 174.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.4 m-80 -66.15 -34.79 78.84 Favored 'General case' 0 N--CA 1.465 0.301 0 O-C-N 120.165 -1.584 . . . . 0.0 110.435 -179.619 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -73.21 -30.85 63.79 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-O 118.004 -0.998 . . . . 0.0 110.459 176.374 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -67.13 -41.92 85.31 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 125.662 1.585 . . . . 0.0 111.045 174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 28.7 mt -80.14 -10.8 59.78 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 119.301 0.955 . . . . 0.0 111.884 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 33.93 56.0 0.59 Allowed 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.972 2.509 . . . . 0.0 114.327 174.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 18.1 mttm 62.88 75.32 0.4 Allowed 'General case' 0 C--O 1.232 0.145 0 C-N-CA 125.523 1.529 . . . . 0.0 109.062 -174.327 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.536 0.431 0 N-CA-C 106.474 -1.676 . . . . 0.0 106.474 -175.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 14.0 pttm . . . . . 0 N--CA 1.447 -0.611 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 5.1 ttp85 91.66 59.05 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 129.605 3.162 . . . . 0.0 111.267 173.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 14.7 t -129.19 -161.75 1.14 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.83 1.252 . . . . 0.0 108.328 179.173 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 32.6 m -156.87 152.88 27.34 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 126.751 2.02 . . . . 0.0 106.328 174.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 3.8 ptt? -51.08 -13.21 0.15 Allowed 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 126.67 1.988 . . . . 0.0 114.786 175.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 10.9 mmt85 -63.66 -32.73 74.3 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-O 116.065 -1.922 . . . . 0.0 110.001 174.073 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 9.1 mm -56.98 -53.14 46.78 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.215 0 CA-C-N 119.965 1.257 . . . . 0.0 108.749 174.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -53.75 -44.5 70.01 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 119.173 -0.441 . . . . 0.0 111.029 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.417 HG22 HD13 ' A' ' 519' ' ' LEU . 93.1 mt -69.98 -53.77 22.19 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.518 0 N-CA-C 112.146 0.424 . . . . 0.0 112.146 179.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -68.41 -36.21 83.62 Favored Glycine 0 CA--C 1.521 0.428 0 C-N-CA 124.462 1.029 . . . . 0.0 113.313 -173.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.42 HD21 HG21 ' A' ' 525' ' ' ILE . 53.3 mt -70.07 -39.08 75.84 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 117.575 0.687 . . . . 0.0 109.657 174.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -62.22 -37.68 86.32 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 118.699 0.681 . . . . 0.0 109.967 174.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . 0.419 ' HA ' ' CD2' ' A' ' 503' ' ' LEU . 4.1 t -59.18 -51.84 67.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.203 0 C-N-CA 124.474 1.11 . . . . 0.0 109.118 173.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -75.29 -20.19 59.26 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 123.106 0.562 . . . . 0.0 111.248 -176.074 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -141.94 80.31 15.62 Favored Pre-proline 0 CA--C 1.533 0.325 0 C-N-CA 126.436 1.894 . . . . 0.0 110.094 -174.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -62.62 -23.73 74.8 Favored 'Trans proline' 0 CA--C 1.534 0.477 0 C-N-CA 121.779 1.653 . . . . 0.0 113.612 -173.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -64.36 -12.78 45.84 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 119.33 0.968 . . . . 0.0 112.921 174.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.507 HD22 ' CD2' ' A' ' 535' ' ' PHE . 34.2 mt -64.08 -16.23 61.29 Favored 'General case' 0 CA--C 1.534 0.332 0 O-C-N 120.673 -1.267 . . . . 0.0 109.564 173.342 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -61.46 -28.38 69.24 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 123.834 0.854 . . . . 0.0 110.873 173.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.9 m -83.86 -14.57 50.87 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.029 0.832 . . . . 0.0 112.15 173.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 7.4 mt -92.75 -8.71 43.0 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 119.389 0.995 . . . . 0.0 111.755 176.486 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 489' ' ' VAL . 6.0 p -81.03 149.01 65.72 Favored Pre-proline 0 CA--C 1.551 1.005 0 CA-C-N 120.406 1.457 . . . . 0.0 109.333 178.15 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo -72.48 170.13 20.09 Favored 'Trans proline' 0 CA--C 1.538 0.693 0 C-N-CA 123.501 2.801 . . . . 0.0 111.446 174.24 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -72.6 10.83 0.92 Allowed 'Trans proline' 0 CA--C 1.546 1.117 0 C-N-CA 123.686 2.924 . . . . 0.0 114.073 177.021 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.527 ' HA ' HD13 ' A' ' 474' ' ' LEU . 3.8 mp 74.73 26.45 1.39 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 128.236 2.615 . . . . 0.0 115.088 173.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 2.9 pm0 -55.57 -16.5 4.04 Favored 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.092 1.886 . . . . 0.0 116.092 -175.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -125.07 16.46 8.48 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.72 1.208 . . . . 0.0 111.555 -178.105 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.608 HD11 ' CZ ' ' A' ' 543' ' ' PHE . 4.5 mp -122.88 -56.45 1.76 Allowed 'General case' 0 C--O 1.234 0.237 0 C-N-CA 124.424 1.09 . . . . 0.0 109.156 -173.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . 0.482 ' C ' ' H ' ' A' ' 477' ' ' ASN . 1.3 t70 50.1 24.03 1.3 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.418 1.887 . . . . 0.0 113.106 178.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 53.67 -11.66 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 1 C-N-CA 133.52 4.728 . . . . 0.0 114.169 -172.931 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 475' ' ' ASP . 25.6 t30 -88.08 -35.08 17.7 Favored 'General case' 0 C--O 1.223 -0.327 0 C-N-CA 131.512 3.925 . . . . 0.0 111.164 -173.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 63.7 mttm -75.07 -9.29 58.4 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 120.552 1.524 . . . . 0.0 110.759 179.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.616 ' HG ' HD21 ' A' ' 546' ' ' LEU . 12.6 mt -135.79 96.19 13.44 Favored Pre-proline 0 N--CA 1.452 -0.332 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 -177.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 86.3 Cg_endo -71.3 82.13 1.13 Allowed 'Trans proline' 0 N--CA 1.456 -0.705 0 C-N-CA 122.8 2.333 . . . . 0.0 110.115 -177.209 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 143.99 -17.03 2.16 Favored Glycine 0 CA--C 1.534 1.23 0 C-N-CA 125.792 1.663 . . . . 0.0 113.353 -174.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.43 ' HB2' ' HB3' ' A' ' 479' ' ' LEU . 2.2 tm? -67.89 -25.05 65.31 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-N 119.931 1.865 . . . . 0.0 109.928 174.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -45.26 -41.87 8.66 Favored Glycine 0 C--O 1.217 -0.927 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 173.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.66 -46.31 87.46 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 118.906 1.353 . . . . 0.0 112.158 177.147 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -61.52 -49.93 74.73 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 123.56 0.744 . . . . 0.0 109.752 175.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -63.75 -49.97 70.89 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.183 -176.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 8.2 tt0 -56.74 -46.93 81.06 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 108.392 -0.966 . . . . 0.0 108.392 -177.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.43 HD11 HD21 ' A' ' 516' ' ' LEU . 11.4 mt -56.42 -51.47 68.24 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 124.001 0.92 . . . . 0.0 111.518 174.0 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.807 HG11 HG11 ' A' ' 468' ' ' VAL . 41.6 t -58.28 -44.31 87.86 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.243 0 CA-C-N 119.486 1.039 . . . . 0.0 110.444 178.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -60.9 -45.53 94.24 Favored 'General case' 0 C--N 1.332 -0.182 0 C-N-CA 125.455 1.502 . . . . 0.0 108.924 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 19.7 m -62.01 -42.77 99.52 Favored 'General case' 0 N--CA 1.444 -0.74 0 C-N-CA 125.496 1.518 . . . . 0.0 109.334 173.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 81.1 m -64.96 -41.79 95.17 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-N 120.756 1.616 . . . . 0.0 110.816 178.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.3 -22.07 65.75 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.504 1.122 . . . . 0.0 111.978 174.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 19.8 t -88.65 -39.08 14.3 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.671 1.188 . . . . 0.0 111.286 177.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 51.6 mm-40 -76.19 105.51 2.31 Favored Pre-proline 0 CA--C 1.543 0.684 0 C-N-CA 124.249 1.02 . . . . 0.0 109.775 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 68.8 Cg_endo -72.83 117.57 5.18 Favored 'Trans proline' 0 N--CA 1.45 -1.083 0 C-N-CA 121.865 1.71 . . . . 0.0 110.513 -173.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 71.05 35.12 64.6 Favored Glycine 0 CA--C 1.527 0.815 0 N-CA-C 112.047 -0.421 . . . . 0.0 112.047 177.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.449 HD21 HD13 ' A' ' 503' ' ' LEU . 21.4 tp -56.83 158.28 4.89 Favored 'General case' 0 CA--C 1.529 0.173 0 C-N-CA 123.612 0.765 . . . . 0.0 111.17 175.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -135.62 168.92 18.37 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 177.603 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 7.2 m -50.48 -51.21 49.3 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 125.204 1.402 . . . . 0.0 110.686 173.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.79 -39.48 33.77 Favored Glycine 0 C--N 1.339 0.738 0 N-CA-C 110.183 -1.167 . . . . 0.0 110.183 -176.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 49.5 tp60 -64.67 -25.45 67.95 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 123.307 0.643 . . . . 0.0 111.48 -177.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.449 HD13 HD21 ' A' ' 498' ' ' LEU . 57.3 tp -59.93 -52.52 65.06 Favored 'General case' 0 CA--C 1.515 -0.389 0 C-N-CA 123.562 0.745 . . . . 0.0 109.408 174.055 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.617 HD21 ' HA ' ' A' ' 517' ' ' GLU . 8.9 mp -62.95 -37.49 87.28 Favored 'General case' 0 CA--C 1.52 -0.191 0 CA-C-O 119.039 -0.505 . . . . 0.0 110.148 179.338 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 8.1 tp10 -60.32 -39.1 85.85 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.11 0.564 . . . . 0.0 111.232 176.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 72.9 t60 -64.69 -20.52 66.36 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 113.13 0.789 . . . . 0.0 113.13 175.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -114.9 16.47 17.22 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 125.444 1.497 . . . . 0.0 109.817 177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 5.9 tpt180 -52.37 125.62 16.65 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 120.123 -1.61 . . . . 0.0 110.072 -176.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 80.36 11.34 84.33 Favored Glycine 0 CA--C 1.534 1.227 0 CA-C-O 118.883 -0.954 . . . . 0.0 113.916 176.44 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.79 HG22 ' H ' ' A' ' 512' ' ' ASN . 35.2 m -93.27 147.4 22.95 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-N 120.133 1.966 . . . . 0.0 108.448 -174.314 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.09 -15.63 46.54 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 112.937 0.717 . . . . 0.0 112.937 177.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.79 ' H ' HG22 ' A' ' 510' ' ' THR . 0.1 OUTLIER -92.3 -17.85 24.17 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 125.694 1.598 . . . . 0.0 112.403 173.921 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.33 -38.27 68.51 Favored 'General case' 0 C--O 1.198 -1.654 0 C-N-CA 124.581 1.152 . . . . 0.0 110.466 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -52.14 -46.24 65.32 Favored 'General case' 0 C--N 1.349 0.58 0 C-N-CA 122.755 0.422 . . . . 0.0 110.618 177.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 97.7 m -61.58 -48.67 79.91 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 121.015 -1.053 . . . . 0.0 109.949 175.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.43 HD21 HD11 ' A' ' 488' ' ' LEU . 94.9 mt -61.81 -40.66 96.02 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 123.678 0.791 . . . . 0.0 111.864 179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.617 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.9 tt0 -62.8 -45.83 90.82 Favored 'General case' 0 C--O 1.243 0.736 0 C-N-CA 125.805 1.642 . . . . 0.0 108.532 178.143 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 15.9 ttpt -63.32 -30.06 71.26 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-O 118.234 -0.889 . . . . 0.0 112.066 174.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.417 HD13 HG22 ' A' ' 455' ' ' ILE . 22.3 mt -85.37 -14.45 46.32 Favored 'General case' 0 C--O 1.224 -0.272 0 CA-C-N 119.857 1.208 . . . . 0.0 113.237 176.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 8.8 t -75.01 -54.83 6.49 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 124.654 1.182 . . . . 0.0 108.175 177.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 4.8 ppp? -74.53 13.01 0.67 Allowed 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 127.068 2.147 . . . . 0.0 113.589 177.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -82.81 97.28 8.54 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 124.824 1.25 . . . . 0.0 113.265 -173.286 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.0 14.11 9.67 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 129.134 2.973 . . . . 0.0 112.526 -175.323 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -61.13 -25.07 66.73 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 126.425 1.89 . . . . 0.0 111.375 175.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.42 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -110.73 -48.55 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.416 0 C-N-CA 127.683 2.393 . . . . 0.0 111.358 176.586 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.411 ' H ' HG12 ' A' ' 525' ' ' ILE . . . 52.31 20.51 1.41 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 128.119 2.568 . . . . 0.0 115.629 177.795 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -137.74 172.14 13.39 Favored 'General case' 0 CA--C 1.542 0.661 0 O-C-N 120.728 -1.232 . . . . 0.0 110.492 -173.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 13.7 ptmt -124.29 -16.49 6.4 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.076 1.35 . . . . 0.0 113.844 177.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -91.36 -53.36 4.37 Favored 'General case' 0 C--N 1.327 -0.387 0 C-N-CA 127.849 2.46 . . . . 0.0 107.756 175.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 90.7 mt -59.34 -25.91 32.29 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-O 118.427 -0.797 . . . . 0.0 109.383 175.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -50.92 -59.52 4.05 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 124.962 1.305 . . . . 0.0 111.185 174.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 7.0 tm-20 -56.6 -44.08 80.77 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 119.05 0.841 . . . . 0.0 111.04 -175.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.37 -51.67 64.9 Favored 'General case' 0 N--CA 1.45 -0.448 0 C-N-CA 123.643 0.777 . . . . 0.0 109.793 178.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 53.1 m -66.36 -30.49 70.9 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 125.151 1.38 . . . . 0.0 110.825 -176.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.507 ' CD2' HD22 ' A' ' 464' ' ' LEU . 81.2 t80 -64.54 -56.18 15.67 Favored 'General case' 0 CA--C 1.516 -0.356 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 176.003 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 98.2 m -59.46 -38.03 79.73 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 123.666 0.786 . . . . 0.0 111.258 177.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -64.11 -47.55 79.58 Favored 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 122.495 1.141 . . . . 0.0 111.237 177.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 24.5 t -65.62 -43.35 89.8 Favored 'General case' 0 CA--C 1.508 -0.639 0 O-C-N 120.788 -1.195 . . . . 0.0 111.581 176.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -52.8 -50.28 63.94 Favored 'General case' 0 N--CA 1.439 -0.997 0 CA-C-N 118.989 0.813 . . . . 0.0 109.906 174.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -57.27 -43.97 83.55 Favored 'General case' 0 C--O 1.214 -0.791 0 C-N-CA 123.346 0.658 . . . . 0.0 109.794 175.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 85.7 t60 -66.73 -40.61 88.44 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 119.312 0.96 . . . . 0.0 111.873 -179.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -57.72 -51.89 67.69 Favored 'General case' 0 C--O 1.222 -0.352 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 174.33 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.608 ' CZ ' HD11 ' A' ' 474' ' ' LEU . 7.0 m-85 -64.73 -41.97 95.56 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.867 0.867 . . . . 0.0 111.316 -177.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -56.6 -49.73 74.04 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 127.344 2.258 . . . . 0.0 109.136 174.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 17.4 t -56.78 -43.79 81.21 Favored 'General case' 0 C--O 1.221 -0.396 0 C-N-CA 123.471 0.708 . . . . 0.0 110.591 176.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.616 HD21 ' HG ' ' A' ' 479' ' ' LEU . 27.8 mt -68.45 -37.25 80.06 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 119.768 1.167 . . . . 0.0 110.358 -177.076 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 72.0 mt -70.27 -41.6 73.23 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.673 -0.68 . . . . 0.0 109.901 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.36 -50.82 68.43 Favored 'General case' 0 N--CA 1.462 0.154 0 C-N-CA 125.347 1.459 . . . . 0.0 109.546 176.382 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 58.5 mt -54.47 -47.14 73.32 Favored 'General case' 0 C--O 1.223 -0.324 0 C-N-CA 124.072 0.949 . . . . 0.0 109.308 176.831 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 1.5 ttt-85 -57.95 -44.84 87.22 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 119.303 0.956 . . . . 0.0 110.909 177.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.67 -52.82 36.35 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.251 1.02 . . . . 0.0 109.87 173.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 13.7 tt0 -64.08 -43.18 96.19 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-N 118.848 0.749 . . . . 0.0 110.53 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . 0.402 ' CG ' HH22 ' A' ' 557' ' ' ARG . 1.5 tp10 -59.98 -39.13 84.65 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 124.802 1.241 . . . . 0.0 110.096 -175.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 3.0 mt -62.63 -53.28 56.95 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.561 1.544 . . . . 0.0 109.379 175.559 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 42.8 mm -60.58 -36.33 69.48 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.872 0 CA-C-N 119.393 0.997 . . . . 0.0 110.93 176.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -64.0 -21.5 66.52 Favored 'General case' 0 CA--C 1.533 0.311 0 O-C-N 120.217 -1.552 . . . . 0.0 111.724 176.58 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . 0.402 HH22 ' CG ' ' A' ' 553' ' ' GLU . 4.2 ttm105 -84.57 -10.67 57.18 Favored 'General case' 0 C--O 1.219 -0.524 0 CA-C-O 115.632 -2.128 . . . . 0.0 111.377 173.772 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -71.92 -64.36 0.95 Allowed 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 121.093 1.769 . . . . 0.0 110.257 174.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 2.0 ppt_? -71.56 3.23 4.11 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 124.816 1.247 . . . . 0.0 114.144 -173.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 46.8 p -118.72 -51.11 2.38 Favored 'General case' 0 N--CA 1.448 -0.528 0 C-N-CA 124.612 1.165 . . . . 0.0 111.343 -179.519 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -113.72 -50.56 2.83 Favored 'General case' 0 N--CA 1.457 -0.123 0 C-N-CA 124.734 1.214 . . . . 0.0 111.163 -174.434 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 123.5 131.91 3.86 Favored Glycine 0 CA--C 1.525 0.697 0 C-N-CA 126.29 1.9 . . . . 0.0 109.712 -177.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 12.8 mt -86.56 137.85 32.18 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 107.648 -1.241 . . . . 0.0 107.648 173.696 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 6.3 t -68.86 167.3 15.9 Favored 'General case' 0 N--CA 1.447 -0.587 0 CA-C-O 122.224 1.012 . . . . 0.0 110.408 173.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -57.72 -42.75 84.45 Favored 'General case' 0 N--CA 1.455 -0.18 0 CA-C-N 115.574 -0.739 . . . . 0.0 109.508 175.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -69.71 -48.77 58.36 Favored 'General case' 0 C--O 1.226 -0.175 0 C-N-CA 124.591 1.156 . . . . 0.0 109.823 -179.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -60.7 -38.82 86.32 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.409 0.684 . . . . 0.0 110.858 -177.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 15.6 ttt180 -62.48 -35.6 79.84 Favored 'General case' 0 CA--C 1.534 0.329 0 O-C-N 121.38 -0.825 . . . . 0.0 109.629 176.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 6.2 mp -71.96 -43.15 65.67 Favored 'General case' 0 N--CA 1.448 -0.537 0 CA-C-O 117.14 -1.41 . . . . 0.0 110.881 173.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -51.99 -37.49 53.36 Favored 'General case' 0 N--CA 1.471 0.575 0 CA-C-N 119.469 1.031 . . . . 0.0 109.522 176.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . . . . . . . . . 4.8 mt -62.9 -42.12 99.67 Favored 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 116.608 -1.663 . . . . 0.0 113.483 174.405 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -58.39 -44.96 89.17 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 121.37 1.896 . . . . 0.0 108.482 175.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -63.8 -48.61 76.2 Favored 'General case' 0 N--CA 1.449 -0.519 0 N-CA-C 108.903 -0.776 . . . . 0.0 108.903 -175.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.6 tp -61.2 -42.11 98.01 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.74 1.216 . . . . 0.0 111.373 177.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -57.35 -45.36 84.42 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.365 0.666 . . . . 0.0 109.333 176.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 22.9 mm100 -73.25 -27.45 61.59 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-O 118.601 -0.714 . . . . 0.0 112.135 -178.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 3.7 mm-40 -68.09 -36.86 80.48 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.667 1.587 . . . . 0.0 109.564 173.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 1.4 mt -81.57 -25.96 35.37 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 123.799 0.84 . . . . 0.0 111.805 177.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 44.04 45.14 6.57 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 126.786 2.034 . . . . 0.0 113.327 -178.544 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 11.8 ptpt -147.04 179.58 7.51 Favored 'General case' 0 N--CA 1.465 0.318 0 O-C-N 121.075 -1.015 . . . . 0.0 110.235 178.344 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.532 0.278 0 CA-C-O 118.429 -0.796 . . . . 0.0 110.953 178.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 24.6 tttt . . . . . 0 CA--C 1.534 0.333 0 N-CA-C 108.228 -1.027 . . . . 0.0 108.228 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.9 163.67 34.1 Favored 'General case' 0 CA--C 1.514 -0.418 0 CA-C-N 120.181 1.355 . . . . 0.0 108.503 179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . 0.421 HG21 ' HA ' ' A' ' 538' ' ' SER . 0.5 OUTLIER -152.07 -176.16 5.54 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.315 178.009 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . 0.476 HG22 ' HG2' ' A' ' 451' ' ' MET . 55.2 m -146.27 -85.95 0.11 Allowed 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 107.508 -1.293 . . . . 0.0 107.508 173.789 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . 0.476 ' HG2' HG22 ' A' ' 450' ' ' THR . 14.9 ptt? -165.74 -44.05 0.03 OUTLIER 'General case' 0 C--O 1.224 -0.243 0 N-CA-C 108.055 -1.091 . . . . 0.0 108.055 -178.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.96 -21.98 65.95 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 116.907 -1.52 . . . . 0.0 111.046 -176.515 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.523 HD13 HG21 ' A' ' 525' ' ' ILE . 0.5 OUTLIER -53.1 -48.74 52.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 C-N-CA 126.181 1.792 . . . . 0.0 109.453 173.369 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.404 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 32.6 mt -53.5 -45.08 69.53 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 118.657 0.662 . . . . 0.0 109.906 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.559 HG23 HD13 ' A' ' 488' ' ' LEU . 95.7 mt -72.18 -51.64 28.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.594 0 CA-C-O 118.022 -0.99 . . . . 0.0 111.341 176.204 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -65.04 -32.43 84.13 Favored Glycine 0 CA--C 1.525 0.669 0 CA-C-N 121.431 1.923 . . . . 0.0 113.373 -173.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.422 ' CD1' HG23 ' A' ' 453' ' ' ILE . 71.4 mt -70.39 -40.22 74.07 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 118.283 -0.865 . . . . 0.0 109.17 174.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -66.83 -34.44 77.82 Favored 'General case' 0 C--O 1.222 -0.353 0 C-N-CA 124.932 1.293 . . . . 0.0 109.99 174.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 16.4 t -60.65 -58.65 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 108.577 -0.897 . . . . 0.0 108.577 174.105 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . 0.537 ' HA ' HG23 ' A' ' 500' ' ' THR . 32.8 mt-30 -71.77 -22.32 61.61 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-O 118.691 -0.671 . . . . 0.0 112.19 -177.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.462 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.1 OUTLIER -135.44 77.53 53.13 Favored Pre-proline 0 CA--C 1.535 0.366 0 C-N-CA 127.051 2.141 . . . . 0.0 108.455 -176.768 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -69.08 -13.67 36.81 Favored 'Trans proline' 0 N--CA 1.46 -0.49 0 C-N-CA 121.311 1.341 . . . . 0.0 112.485 -177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -70.49 -19.79 62.9 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.725 0.81 . . . . 0.0 111.323 173.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.462 HD12 ' HB3' ' A' ' 461' ' ' ASN . 36.0 mt -62.96 -15.66 56.69 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 120.399 1.454 . . . . 0.0 110.571 175.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.505 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -64.65 -30.97 72.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 119.36 0.982 . . . . 0.0 110.832 174.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.1 m -74.84 -19.48 60.16 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.997 0.817 . . . . 0.0 110.792 174.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 25.1 mt -91.0 -22.56 20.74 Favored 'General case' 0 N--CA 1.455 -0.182 0 O-C-N 120.865 -1.147 . . . . 0.0 110.798 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 489' ' ' VAL . 0.3 OUTLIER -70.06 156.34 91.96 Favored Pre-proline 0 CA--C 1.552 1.025 0 CA-C-N 118.947 0.794 . . . . 0.0 110.244 179.299 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.673 ' HD2' HG22 ' A' ' 468' ' ' VAL . 23.0 Cg_endo -74.74 174.01 13.42 Favored 'Trans proline' 0 N--CA 1.46 -0.452 0 C-N-CA 124.475 3.45 . . . . 0.0 112.448 176.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -76.71 12.04 1.77 Allowed 'Trans proline' 0 CA--C 1.546 1.103 0 C-N-CA 121.698 1.599 . . . . 0.0 113.519 175.394 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.564 HD22 ' HG3' ' A' ' 486' ' ' ARG . 10.2 mp 64.54 46.86 3.11 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 127.766 2.426 . . . . 0.0 112.428 176.259 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -74.03 -42.12 60.78 Favored 'General case' 0 N--CA 1.472 0.627 0 N-CA-C 114.336 1.236 . . . . 0.0 114.336 -177.369 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -105.68 17.76 23.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.765 1.226 . . . . 0.0 111.053 -175.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.618 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 3.5 mm? -97.64 -77.56 0.5 Allowed 'General case' 0 N--CA 1.444 -0.766 0 N-CA-C 106.968 -1.493 . . . . 0.0 106.968 -173.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 31.3 t0 64.41 141.42 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 127.258 2.223 . . . . 0.0 112.781 -175.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -68.44 -20.06 64.61 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 120.997 -1.065 . . . . 0.0 109.547 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 6.3 t-20 -62.31 -45.61 92.47 Favored 'General case' 0 C--N 1.341 0.223 0 C-N-CA 124.93 1.292 . . . . 0.0 110.285 173.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -80.62 -35.74 33.6 Favored 'General case' 0 C--N 1.341 0.215 0 O-C-N 121.661 -0.649 . . . . 0.0 110.124 -175.077 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 546' ' ' LEU . 2.4 mm? -121.37 103.58 41.45 Favored Pre-proline 0 CA--C 1.534 0.344 0 C-N-CA 124.032 0.933 . . . . 0.0 108.876 -176.605 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -70.11 -20.45 33.19 Favored 'Trans proline' 0 CA--C 1.536 0.599 0 C-N-CA 121.544 1.496 . . . . 0.0 112.356 -177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -92.9 -8.9 61.47 Favored Glycine 0 CA--C 1.527 0.815 0 CA-C-O 118.703 -1.054 . . . . 0.0 112.742 174.607 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -69.56 -32.33 71.05 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-O 116.256 -1.831 . . . . 0.0 109.721 177.374 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -46.46 -48.73 16.36 Favored Glycine 0 CA--C 1.53 1.026 0 CA-C-N 120.572 1.533 . . . . 0.0 111.238 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.68 -44.89 95.09 Favored 'General case' 0 CA--C 1.534 0.358 0 O-C-N 121.836 -0.803 . . . . 0.0 111.692 175.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.404 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 57.4 t80 -64.37 -48.79 74.15 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 119.115 0.871 . . . . 0.0 111.718 179.544 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.564 ' HG3' HD22 ' A' ' 471' ' ' LEU . 0.3 OUTLIER -54.23 -53.63 51.0 Favored 'General case' 0 CA--C 1.504 -0.811 0 C-N-CA 125.272 1.429 . . . . 0.0 108.186 175.737 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 2.1 tt0 -60.07 -41.58 92.72 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 119.629 1.104 . . . . 0.0 110.872 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.559 HD13 HG23 ' A' ' 455' ' ' ILE . 3.4 mt -56.42 -56.86 15.88 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 124.136 0.974 . . . . 0.0 110.158 173.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.733 HG11 HG11 ' A' ' 468' ' ' VAL . 53.5 t -58.7 -46.34 90.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 118.182 -0.913 . . . . 0.0 109.428 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -55.97 -46.45 78.61 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 125.779 1.632 . . . . 0.0 108.755 -177.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 24.0 m -62.15 -44.13 97.3 Favored 'General case' 0 N--CA 1.446 -0.675 0 C-N-CA 125.81 1.644 . . . . 0.0 111.072 174.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 84.3 m -65.19 -37.12 86.34 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 119.069 0.849 . . . . 0.0 110.594 178.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -63.12 -28.42 70.05 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 125.003 1.321 . . . . 0.0 109.679 174.329 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -77.67 -57.09 4.0 Favored 'General case' 0 N--CA 1.445 -0.694 0 O-C-N 121.26 -0.9 . . . . 0.0 110.329 174.585 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -61.03 108.59 1.55 Allowed Pre-proline 0 CA--C 1.543 0.706 0 C-N-CA 124.604 1.162 . . . . 0.0 110.241 -175.058 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_endo -73.81 141.02 29.83 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 C-N-CA 122.238 1.959 . . . . 0.0 109.398 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 50.24 33.58 23.59 Favored Glycine 0 CA--C 1.524 0.604 0 C-N-CA 125.097 1.332 . . . . 0.0 111.873 -179.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 36.8 tp -54.03 156.3 3.06 Favored 'General case' 0 N--CA 1.45 -0.441 0 CA-C-O 122.976 1.37 . . . . 0.0 109.651 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . 0.404 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.2 p -135.05 163.77 29.13 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 179.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.537 HG23 ' HA ' ' A' ' 460' ' ' GLN . 8.3 m -50.84 -46.97 60.32 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 125.593 1.557 . . . . 0.0 110.468 174.008 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -75.93 -41.6 27.38 Favored Glycine 0 N--CA 1.439 -1.112 0 N-CA-C 110.641 -0.984 . . . . 0.0 110.641 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.404 ' HB3' ' H ' ' A' ' 499' ' ' THR . 28.1 tp60 -62.33 -24.67 67.46 Favored 'General case' 0 N--CA 1.452 -0.329 0 O-C-N 121.609 -0.936 . . . . 0.0 110.459 -178.861 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 40.9 tp -68.37 -45.36 72.98 Favored 'General case' 0 CA--C 1.514 -0.412 0 CA-C-N 119.606 1.094 . . . . 0.0 108.902 174.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 10.7 mp -60.66 -38.62 85.47 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 118.608 -0.711 . . . . 0.0 111.012 175.677 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -68.26 -39.35 82.23 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 123.126 0.571 . . . . 0.0 111.355 177.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 71.2 t60 -66.98 -20.46 65.89 Favored 'General case' 0 CA--C 1.531 0.25 0 O-C-N 120.539 -1.35 . . . . 0.0 112.144 179.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 46.7 m-85 -111.35 15.05 21.55 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 124.476 1.11 . . . . 0.0 109.931 177.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 6.5 tpt180 -54.63 128.59 33.09 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 119.985 -1.697 . . . . 0.0 110.173 -175.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 76.7 15.42 81.6 Favored Glycine 0 CA--C 1.533 1.198 0 CA-C-O 119.272 -0.738 . . . . 0.0 114.108 178.139 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.83 HG22 ' H ' ' A' ' 512' ' ' ASN . 53.7 m -93.98 145.95 24.28 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 118.885 1.343 . . . . 0.0 110.844 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -59.41 -22.87 62.06 Favored 'General case' 0 N--CA 1.475 0.794 0 O-C-N 121.025 -1.047 . . . . 0.0 111.427 174.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.83 ' H ' HG22 ' A' ' 510' ' ' THR . 0.9 OUTLIER -92.63 -13.95 28.83 Favored 'General case' 0 C--O 1.221 -0.406 0 C-N-CA 123.786 0.835 . . . . 0.0 112.533 178.593 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -55.29 -43.23 74.58 Favored 'General case' 0 C--O 1.209 -1.028 0 O-C-N 123.558 0.536 . . . . 0.0 109.735 173.55 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -55.46 -43.51 75.56 Favored 'General case' 0 CA--C 1.533 0.292 0 CA-C-N 119.618 1.099 . . . . 0.0 112.624 177.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 87.3 m -63.24 -50.06 71.71 Favored 'General case' 0 N--CA 1.454 -0.251 0 O-C-N 121.376 -0.827 . . . . 0.0 109.141 174.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.516 HD21 HD11 ' A' ' 488' ' ' LEU . 48.7 mt -58.74 -42.15 88.11 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.565 0.746 . . . . 0.0 112.399 -178.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 1.4 tt0 -67.74 -42.74 81.36 Favored 'General case' 0 C--N 1.331 -0.226 0 C-N-CA 126.304 1.842 . . . . 0.0 108.608 -179.463 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 5.8 tmtm? -59.15 -30.68 68.33 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-O 118.515 -0.755 . . . . 0.0 111.01 173.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 56.3 mt -89.29 -3.86 58.35 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 119.19 0.905 . . . . 0.0 111.913 176.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 15.0 t -79.1 -50.48 10.97 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 125.117 1.367 . . . . 0.0 109.396 175.651 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -82.57 9.77 8.7 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 113.906 1.076 . . . . 0.0 113.906 177.408 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.458 ' CE3' HD11 ' A' ' 525' ' ' ILE . 3.2 t90 -59.97 112.67 1.96 Allowed 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 125.556 1.542 . . . . 0.0 115.01 -173.321 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -77.96 -29.22 49.69 Favored 'General case' 0 C--N 1.326 -0.432 1 C-N-CA 131.76 4.024 . . . . 0.0 114.389 -178.369 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -53.81 -27.31 28.57 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 126.224 1.81 . . . . 0.0 112.786 177.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.523 HG21 HD13 ' A' ' 453' ' ' ILE . 1.2 pt -123.53 -66.88 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.455 -0.214 0 C-N-CA 124.673 1.189 . . . . 0.0 110.472 -179.307 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 47.23 42.32 13.29 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.243 1.417 . . . . 0.0 114.005 175.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -139.58 172.13 13.24 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 120.856 -1.152 . . . . 0.0 111.4 178.183 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.44 -27.96 3.39 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 126.938 2.095 . . . . 0.0 111.906 175.32 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -80.9 -54.48 5.55 Favored 'General case' 0 N--CA 1.449 -0.506 0 C-N-CA 124.413 1.085 . . . . 0.0 108.513 176.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 19.2 mt -65.84 -15.0 18.08 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.452 0 C-N-CA 124.721 1.208 . . . . 0.0 109.598 173.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.417 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -61.41 -60.95 2.93 Favored 'General case' 0 C--O 1.218 -0.585 0 CA-C-N 119.969 1.259 . . . . 0.0 110.746 173.879 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -55.96 -40.72 73.65 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 118.912 0.778 . . . . 0.0 111.31 -177.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.22 -53.1 54.52 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 122.194 -0.316 . . . . 0.0 111.541 177.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 86.4 m -63.78 -27.39 69.15 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.184 0.993 . . . . 0.0 110.758 177.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.462 ' CD2' HD22 ' A' ' 464' ' ' LEU . 54.6 t80 -67.72 -53.25 28.97 Favored 'General case' 0 CA--C 1.511 -0.543 0 CA-C-N 120.173 1.351 . . . . 0.0 107.684 178.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 72.9 m -66.22 -39.09 89.34 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 118.291 -0.862 . . . . 0.0 111.213 -179.478 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -61.38 -44.33 97.35 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 119.612 1.097 . . . . 0.0 109.614 175.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . 0.421 ' HA ' HG21 ' A' ' 449' ' ' THR . 14.8 t -61.22 -55.11 35.82 Favored 'General case' 0 N--CA 1.453 -0.279 0 O-C-N 120.954 -1.091 . . . . 0.0 110.604 176.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.12 -44.34 79.04 Favored 'General case' 0 CA--C 1.51 -0.575 0 C-N-CA 125.009 1.323 . . . . 0.0 108.831 -178.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -61.01 -44.0 98.06 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-N 119.353 0.979 . . . . 0.0 110.428 177.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 23.6 t-160 -67.55 -40.75 84.97 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-N 118.891 0.769 . . . . 0.0 111.539 179.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 5.2 mmt -59.44 -53.1 62.08 Favored 'General case' 0 N--CA 1.446 -0.661 0 O-C-N 121.14 -0.975 . . . . 0.0 109.504 173.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.618 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 5.6 m-85 -59.69 -45.09 93.15 Favored 'General case' 0 CA--C 1.534 0.333 0 C-N-CA 123.545 0.738 . . . . 0.0 111.428 -179.437 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -57.67 -46.76 83.83 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 125.051 1.34 . . . . 0.0 109.807 177.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 2.7 t -56.15 -39.12 71.8 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 123.484 0.714 . . . . 0.0 110.893 174.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.707 HD21 HD21 ' A' ' 479' ' ' LEU . 38.2 mt -73.89 -35.04 64.65 Favored 'General case' 0 CA--C 1.519 -0.234 0 O-C-N 120.675 -1.266 . . . . 0.0 110.819 -178.23 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.8 -43.6 79.3 Favored 'General case' 0 N--CA 1.452 -0.333 0 C-N-CA 124.661 1.185 . . . . 0.0 108.737 175.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . 0.506 ' OE2' ' HE2' ' A' ' 581' ' ' LYS . 6.6 tt0 -59.49 -53.58 56.53 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 124.554 1.142 . . . . 0.0 110.571 174.103 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 56.5 mt -57.41 -43.21 83.56 Favored 'General case' 0 C--O 1.226 -0.182 0 O-C-N 121.815 -0.553 . . . . 0.0 110.325 175.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 19.4 ttt85 -59.29 -44.06 92.52 Favored 'General case' 0 C--N 1.34 0.171 0 CA-C-O 117.231 -1.366 . . . . 0.0 109.464 178.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -54.38 -50.74 66.8 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 119.329 0.968 . . . . 0.0 110.209 176.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.58 -44.92 89.14 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 118.675 -0.678 . . . . 0.0 110.039 -178.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -60.93 -41.42 96.19 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.159 0.984 . . . . 0.0 109.769 -178.078 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . . . . . . . . . 10.7 mt -60.85 -52.46 64.97 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.602 1.561 . . . . 0.0 108.909 177.161 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.419 HD13 HD13 ' A' ' 571' ' ' LEU . 47.3 mm -61.62 -36.27 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.775 0 CA-C-N 119.967 1.258 . . . . 0.0 111.162 174.081 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.47 -24.88 66.88 Favored 'General case' 0 CA--C 1.536 0.413 0 O-C-N 120.277 -1.514 . . . . 0.0 110.745 176.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -84.65 -7.03 59.38 Favored 'General case' 0 C--O 1.221 -0.399 0 CA-C-O 115.808 -2.044 . . . . 0.0 111.659 173.409 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -68.13 -60.33 2.56 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 122.54 2.427 . . . . 0.0 106.525 173.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.2 tmm_? -76.08 -4.4 41.23 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 120.301 -1.499 . . . . 0.0 113.99 -173.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 63.3 p -114.88 -63.67 1.42 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 121.171 1.805 . . . . 0.0 109.884 -176.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.2 m170 -74.89 -44.51 48.46 Favored 'General case' 0 N--CA 1.453 -0.293 0 C-N-CA 124.538 1.135 . . . . 0.0 111.499 174.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 111.99 3.98 26.17 Favored Glycine 0 CA--C 1.524 0.629 0 CA-C-O 116.339 -2.367 . . . . 0.0 113.65 -173.452 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 4.1 mt 41.17 -159.05 0.01 OUTLIER 'General case' 0 N--CA 1.428 -1.551 0 C-N-CA 127.866 2.467 . . . . 0.0 110.915 -173.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 29.6 t -139.33 160.23 40.32 Favored 'General case' 0 CA--C 1.5 -0.97 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 174.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.35 -40.17 74.07 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 109.278 -0.638 . . . . 0.0 109.278 177.958 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.3 -52.09 13.29 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 123.884 0.874 . . . . 0.0 109.603 -178.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -58.96 -36.54 75.0 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 119.297 0.953 . . . . 0.0 111.325 -179.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 17.8 ttt85 -61.83 -32.58 72.91 Favored 'General case' 0 CA--C 1.532 0.288 0 O-C-N 120.128 -1.608 . . . . 0.0 111.138 175.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 85.9 mt -80.71 -33.44 35.32 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.856 -0.592 . . . . 0.0 110.954 175.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -53.36 -46.1 69.44 Favored 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 173.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.419 HD13 HD13 ' A' ' 555' ' ' ILE . 5.5 mt -56.45 -40.5 74.92 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 116.868 -1.539 . . . . 0.0 113.605 174.435 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -60.61 -44.42 96.33 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 122.405 2.366 . . . . 0.0 109.071 175.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 2.8 m -62.31 -47.61 83.5 Favored 'General case' 0 CA--C 1.528 0.112 0 O-C-N 125.114 1.509 . . . . 0.0 107.215 -175.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.99 -41.28 87.24 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 120.712 -1.242 . . . . 0.0 111.001 177.236 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -65.08 -37.14 86.55 Favored 'General case' 0 C--O 1.231 0.114 0 O-C-N 121.041 -1.037 . . . . 0.0 111.184 -178.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 94.3 mm-40 -75.53 -25.38 57.14 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 117.679 -1.153 . . . . 0.0 110.364 175.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -66.88 -45.58 77.6 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 119.416 1.007 . . . . 0.0 108.339 174.637 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 4.9 mt -80.46 -7.53 59.19 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.782 1.233 . . . . 0.0 112.844 179.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 31.23 50.07 0.11 Allowed 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 128.271 2.628 . . . . 0.0 115.563 174.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 63.44 78.37 0.29 Allowed 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 126.687 1.995 . . . . 0.0 109.888 -175.296 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . 0.506 ' HE2' ' OE2' ' A' ' 548' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.237 0.401 0 C-N-CA 127.916 2.486 . . . . 0.0 113.945 178.963 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 5.8 mptt . . . . . 0 C--O 1.224 -0.277 0 CA-C-O 120.908 0.385 . . . . 0.0 110.4 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 27.8 mtt-85 -99.17 -68.51 0.8 Allowed 'General case' 0 CA--C 1.511 -0.553 0 C-N-CA 124.162 0.985 . . . . 0.0 108.863 176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 1.1 m -159.9 146.0 15.81 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 -176.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 450' ' ' THR . 2.7 t -152.8 39.4 0.54 Allowed 'General case' 0 C--N 1.326 -0.414 0 C-N-CA 123.764 0.825 . . . . 0.0 109.582 175.237 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER 79.6 -38.89 0.19 Allowed 'General case' 0 N--CA 1.481 1.105 0 O-C-N 121.174 -0.954 . . . . 0.0 110.841 177.502 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 71.2 mtt-85 -56.76 -27.64 59.81 Favored 'General case' 0 CA--C 1.497 -1.076 0 CA-C-O 115.513 -2.184 . . . . 0.0 109.978 173.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 6.8 mm -64.77 -53.22 44.62 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.616 0 CA-C-N 119.858 1.208 . . . . 0.0 108.861 174.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.458 HD23 ' CE1' ' A' ' 535' ' ' PHE . 11.6 mt -59.44 -46.8 87.73 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 119.394 0.997 . . . . 0.0 110.147 -178.033 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.647 ' CG2' HD13 ' A' ' 519' ' ' LEU . 15.7 mt -68.29 -57.87 7.76 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.999 0 CA-C-O 119.135 -0.46 . . . . 0.0 111.973 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . 0.508 ' HA3' ' CE3' ' A' ' 522' ' ' TRP . . . -52.62 -42.52 58.4 Favored Glycine 0 N--CA 1.448 -0.564 0 C-N-CA 126.285 1.898 . . . . 0.0 111.577 -178.318 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.883 HD21 HG21 ' A' ' 525' ' ' ILE . 97.4 mt -68.26 -44.25 76.0 Favored 'General case' 0 CA--C 1.501 -0.931 0 CA-C-O 117.693 -1.146 . . . . 0.0 109.686 173.662 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.479 ' O ' HD13 ' A' ' 458' ' ' LEU . 3.4 tm? -59.78 -30.78 69.12 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.626 1.103 . . . . 0.0 110.893 175.735 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 2.8 t -67.11 -49.94 68.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.353 0 N-CA-C 107.602 -1.259 . . . . 0.0 107.602 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 10.8 mt-30 -74.96 -18.89 60.31 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.484 0.659 . . . . 0.0 111.922 178.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.751 ' HB3' HD12 ' A' ' 464' ' ' LEU . 7.6 t-20 -137.56 83.82 24.43 Favored Pre-proline 0 N--CA 1.44 -0.945 0 O-C-N 120.809 -1.182 . . . . 0.0 107.862 -173.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . 0.624 ' HB3' HD23 ' A' ' 498' ' ' LEU . 23.8 Cg_endo -68.51 -19.86 42.15 Favored 'Trans proline' 0 N--CA 1.45 -1.078 0 C-N-CA 121.596 1.531 . . . . 0.0 111.852 178.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -63.03 -28.54 70.16 Favored 'General case' 0 C--O 1.223 -0.308 0 CA-C-O 118.453 -0.784 . . . . 0.0 110.214 173.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.817 HD22 ' CD2' ' A' ' 535' ' ' PHE . 15.8 mt -59.87 -16.98 33.24 Favored 'General case' 0 N--CA 1.471 0.589 0 O-C-N 120.609 -1.307 . . . . 0.0 111.766 -179.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.711 ' HB1' HG13 ' A' ' 489' ' ' VAL . . . -60.08 -27.47 67.01 Favored 'General case' 0 N--CA 1.447 -0.617 0 O-C-N 121.85 -0.531 . . . . 0.0 111.221 173.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 23.8 m -82.16 -16.51 49.56 Favored 'General case' 0 C--N 1.322 -0.62 0 O-C-N 120.139 -1.601 . . . . 0.0 112.847 176.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . 0.58 HD12 HD23 ' A' ' 464' ' ' LEU . 8.3 mt -85.16 -18.57 33.73 Favored 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.777 1.231 . . . . 0.0 108.827 175.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 489' ' ' VAL . 0.5 OUTLIER -66.87 148.63 98.78 Favored Pre-proline 0 N--CA 1.439 -0.99 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.782 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.668 ' HD2' HG22 ' A' ' 468' ' ' VAL . 13.6 Cg_endo -73.95 179.43 5.72 Favored 'Trans proline' 0 N--CA 1.445 -1.364 0 C-N-CA 122.099 1.866 . . . . 0.0 111.04 178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -79.72 14.45 1.85 Allowed 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.826 3.018 . . . . 0.0 112.208 174.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.541 HD13 HD12 ' A' ' 474' ' ' LEU . 0.3 OUTLIER 69.09 70.35 0.27 Allowed 'General case' 0 CA--C 1.51 -0.574 0 C-N-CA 126.375 1.87 . . . . 0.0 107.693 174.412 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -105.39 -57.79 1.99 Allowed 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.062 -177.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -80.79 11.93 3.56 Favored 'General case' 0 CA--C 1.498 -1.046 0 C-N-CA 123.565 0.746 . . . . 0.0 112.491 174.347 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.841 HD13 HD21 ' A' ' 482' ' ' LEU . 36.8 mt -119.59 -49.99 2.33 Favored 'General case' 0 N--CA 1.442 -0.859 0 C-N-CA 123.915 0.886 . . . . 0.0 111.389 -173.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 3.4 t70 46.39 25.45 0.38 Allowed 'General case' 0 C--N 1.363 1.184 0 C-N-CA 128.6 2.76 . . . . 0.0 111.165 177.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 40.9 26.39 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 129.378 3.071 . . . . 0.0 112.874 -175.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -135.1 15.6 3.51 Favored 'General case' 0 N--CA 1.444 -0.729 0 C-N-CA 131.377 3.871 . . . . 0.0 111.607 -177.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.521 ' HB3' HD22 ' A' ' 546' ' ' LEU . 5.4 mmpt? -97.49 -42.76 7.56 Favored 'General case' 0 N--CA 1.426 -1.66 0 C-N-CA 120.18 -0.608 . . . . 0.0 109.591 174.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 482' ' ' LEU . 2.1 mm? -121.98 145.47 43.78 Favored Pre-proline 0 N--CA 1.428 -1.537 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 -177.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -72.5 5.67 2.7 Favored 'Trans proline' 0 N--CA 1.477 0.544 0 C-N-CA 123.314 2.676 . . . . 0.0 114.258 178.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -125.32 -11.28 4.25 Favored Glycine 0 N--CA 1.44 -1.074 0 CA-C-O 116.752 -2.138 . . . . 0.0 109.593 173.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.898 HD23 HD23 ' A' ' 479' ' ' LEU . 0.3 OUTLIER -53.35 -45.08 69.01 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 119.905 1.852 . . . . 0.0 107.565 -178.469 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -50.75 -49.5 40.7 Favored Glycine 0 C--N 1.346 1.103 0 N-CA-C 111.1 -0.8 . . . . 0.0 111.1 176.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 30.2 tp -61.38 -53.19 59.81 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 118.281 1.041 . . . . 0.0 111.085 178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.419 ' O ' HG23 ' A' ' 489' ' ' VAL . 12.6 t80 -52.41 -48.08 65.92 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 123.534 0.734 . . . . 0.0 110.865 175.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 tmt_? -59.67 -50.84 72.29 Favored 'General case' 0 N--CA 1.439 -0.977 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -178.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -61.74 -44.56 96.68 Favored 'General case' 0 N--CA 1.445 -0.698 0 C-N-CA 123.818 0.847 . . . . 0.0 111.324 -177.477 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.605 HD11 HD21 ' A' ' 516' ' ' LEU . 4.7 mt -59.17 -45.56 90.69 Favored 'General case' 0 N--CA 1.445 -0.693 0 C-N-CA 124.232 1.013 . . . . 0.0 109.755 177.705 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.878 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -65.69 -45.05 93.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.501 0 CA-C-O 118.496 -0.764 . . . . 0.0 109.517 176.216 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -54.19 -42.85 70.18 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 124.379 1.071 . . . . 0.0 109.776 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 2.3 m -71.65 -43.26 66.39 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 115.221 -0.9 . . . . 0.0 110.173 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.477 ' HA ' HD22 ' A' ' 498' ' ' LEU . 57.4 m -55.85 -48.41 75.56 Favored 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.776 1.171 . . . . 0.0 109.583 177.306 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -59.1 -21.27 58.99 Favored 'General case' 0 C--O 1.216 -0.675 0 C-N-CA 125.85 1.66 . . . . 0.0 110.745 177.276 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -83.5 -53.48 5.66 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 124.075 0.95 . . . . 0.0 109.791 173.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 18.5 mm100 -63.12 104.64 0.52 Allowed Pre-proline 0 N--CA 1.468 0.452 0 C-N-CA 125.837 1.655 . . . . 0.0 110.496 -176.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_endo -70.5 133.21 23.71 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 121.328 1.352 . . . . 0.0 110.485 -178.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 52.79 37.91 52.8 Favored Glycine 0 N--CA 1.469 0.853 0 N-CA-C 111.262 -0.735 . . . . 0.0 111.262 -178.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.637 HD21 HD13 ' A' ' 503' ' ' LEU . 43.3 tp -57.82 156.09 9.37 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.393 0.616 . . . . 0.0 109.935 -179.696 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -134.48 168.36 19.08 Favored 'General case' 0 N--CA 1.443 -0.797 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 -174.417 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.0 m -58.18 -38.03 75.89 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.55 0.74 . . . . 0.0 110.041 173.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -84.18 -41.38 8.04 Favored Glycine 0 C--N 1.339 0.724 0 O-C-N 120.798 -1.189 . . . . 0.0 110.431 -177.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.496 ' HB3' HD12 ' A' ' 498' ' ' LEU . 39.3 tp60 -60.57 -27.87 68.02 Favored 'General case' 0 C--O 1.219 -0.534 0 CA-C-O 117.679 -1.153 . . . . 0.0 109.691 179.034 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.637 HD13 HD21 ' A' ' 498' ' ' LEU . 30.2 tp -64.39 -53.81 42.72 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 119.601 1.091 . . . . 0.0 109.646 177.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.517 HD21 ' HB2' ' A' ' 520' ' ' SER . 4.3 mm? -61.28 -34.58 75.43 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 121.082 0.468 . . . . 0.0 110.457 179.573 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 6.5 tt0 -71.94 -35.46 69.63 Favored 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 123.327 0.651 . . . . 0.0 111.946 177.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 46.6 t60 -72.55 -5.21 35.47 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 127.089 2.156 . . . . 0.0 111.676 175.107 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.598 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 44.0 m-85 -122.83 18.29 10.21 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 125.864 1.666 . . . . 0.0 109.774 174.058 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -61.67 134.51 56.88 Favored 'General case' 0 CA--C 1.516 -0.364 0 O-C-N 119.525 -1.985 . . . . 0.0 109.292 -176.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 70.53 21.44 77.63 Favored Glycine 0 C--N 1.335 0.498 0 C-N-CA 120.325 -0.941 . . . . 0.0 111.023 176.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.881 HG22 ' H ' ' A' ' 512' ' ' ASN . 95.3 m -94.43 144.78 25.27 Favored 'General case' 0 C--O 1.232 0.184 0 CA-C-N 119.341 1.571 . . . . 0.0 108.697 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 56.1 t30 -63.02 -17.27 62.03 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 121.469 -0.769 . . . . 0.0 109.11 173.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.881 ' H ' HG22 ' A' ' 510' ' ' THR . 42.8 m-80 -96.95 -20.59 17.99 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 119.318 -2.114 . . . . 0.0 111.246 176.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . 0.598 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -45.18 -39.78 6.54 Favored 'General case' 0 C--O 1.208 -1.13 0 O-C-N 124.889 1.368 . . . . 0.0 109.278 178.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -56.16 -56.48 20.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.568 1.147 . . . . 0.0 111.201 177.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 98.4 m -57.86 -41.56 82.67 Favored 'General case' 0 CA--C 1.516 -0.354 0 O-C-N 120.675 -1.265 . . . . 0.0 110.713 174.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.605 HD21 HD11 ' A' ' 488' ' ' LEU . 28.8 mt -64.96 -31.62 72.94 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-O 118.269 -0.872 . . . . 0.0 111.808 175.611 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.493 ' HA ' HD11 ' A' ' 504' ' ' LEU . 0.0 OUTLIER -72.94 -45.45 57.97 Favored 'General case' 0 CA--C 1.506 -0.75 0 C-N-CA 125.95 1.7 . . . . 0.0 109.284 -176.174 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.84 -35.73 80.91 Favored 'General case' 0 N--CA 1.444 -0.725 0 C-N-CA 119.639 -0.825 . . . . 0.0 109.72 175.988 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.647 HD13 ' CG2' ' A' ' 455' ' ' ILE . 48.0 mt -77.69 -13.61 59.85 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-O 119.079 -0.486 . . . . 0.0 111.86 177.917 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . 0.517 ' HB2' HD21 ' A' ' 504' ' ' LEU . 10.2 t -76.48 -60.82 2.18 Favored 'General case' 0 CA--C 1.521 -0.142 0 C-N-CA 126.012 1.725 . . . . 0.0 108.215 178.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -70.53 -2.52 14.32 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 112.644 0.609 . . . . 0.0 112.644 177.362 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.601 ' CE3' HD11 ' A' ' 525' ' ' ILE . 1.3 t90 -49.49 115.75 1.47 Allowed 'General case' 0 N--CA 1.443 -0.788 0 C-N-CA 123.456 0.703 . . . . 0.0 109.962 179.782 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -103.09 2.76 35.14 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 114.282 -1.326 . . . . 0.0 108.925 -178.107 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -54.87 -23.83 20.39 Favored 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 118.776 0.717 . . . . 0.0 112.411 178.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.883 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -109.68 -53.73 5.77 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.614 0 C-N-CA 127.469 2.308 . . . . 0.0 109.493 178.878 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 43.28 47.61 5.63 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 125.627 1.571 . . . . 0.0 111.159 -178.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 6.3 t70 -161.11 151.05 17.27 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 107.61 -1.256 . . . . 0.0 107.61 -174.639 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -107.97 -33.44 7.2 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 125.968 1.707 . . . . 0.0 113.021 175.552 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -76.96 -60.48 2.34 Favored 'General case' 0 CA--C 1.51 -0.565 0 C-N-CA 126.492 1.917 . . . . 0.0 109.456 177.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 87.2 mt -55.26 -29.39 23.15 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.763 0 CA-C-O 117.071 -1.443 . . . . 0.0 107.173 178.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.439 ' HA ' HD22 ' A' ' 457' ' ' LEU . . . -46.9 -55.07 8.65 Favored 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 120.256 1.389 . . . . 0.0 111.514 175.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -56.4 -43.99 79.84 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 119.193 0.906 . . . . 0.0 110.23 178.635 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -48.35 79.43 Favored 'General case' 0 C--O 1.219 -0.549 0 CA-C-O 118.773 -0.632 . . . . 0.0 111.372 177.48 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 40.2 m -64.14 -31.15 72.24 Favored 'General case' 0 N--CA 1.449 -0.493 0 C-N-CA 126.358 1.863 . . . . 0.0 108.281 -177.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.817 ' CD2' HD22 ' A' ' 464' ' ' LEU . 41.5 t80 -69.25 -59.28 3.12 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 124.853 1.261 . . . . 0.0 109.807 178.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 97.4 m -58.38 -40.16 81.57 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 118.353 -0.832 . . . . 0.0 109.493 178.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -59.57 -45.19 92.58 Favored 'General case' 0 CA--C 1.508 -0.648 0 CA-C-N 118.577 0.626 . . . . 0.0 112.151 176.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 21.9 t -67.48 -50.95 56.72 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-O 117.6 -1.191 . . . . 0.0 110.385 -178.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -54.45 -44.79 72.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 125.981 1.712 . . . . 0.0 108.567 178.828 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -63.88 -38.69 92.01 Favored 'General case' 0 C--N 1.356 0.876 0 O-C-N 124.721 1.263 . . . . 0.0 110.532 175.441 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 31.4 t-80 -72.42 -39.41 67.9 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 119.146 0.885 . . . . 0.0 109.051 -176.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.25 -59.85 4.43 Favored 'General case' 0 CA--C 1.506 -0.716 0 C-N-CA 126.198 1.799 . . . . 0.0 107.462 179.83 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.643 ' CE1' HD21 ' A' ' 474' ' ' LEU . 3.3 m-85 -54.54 -46.47 73.6 Favored 'General case' 0 N--CA 1.451 -0.409 0 O-C-N 125.014 1.446 . . . . 0.0 110.055 -179.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -56.97 -48.89 77.32 Favored 'General case' 0 C--O 1.221 -0.43 0 C-N-CA 124.078 0.951 . . . . 0.0 109.254 178.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.72 -47.59 67.22 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.521 HD22 ' HB3' ' A' ' 478' ' ' LYS . 20.4 mt -63.8 -45.77 88.16 Favored 'General case' 0 C--N 1.329 -0.307 0 O-C-N 122.219 -0.3 . . . . 0.0 110.359 -179.153 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 11.1 mt -57.93 -37.02 73.33 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 118.467 -0.778 . . . . 0.0 110.495 175.525 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -63.06 -50.15 71.71 Favored 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 124.89 1.276 . . . . 0.0 109.519 177.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 1.4 mt -60.77 -48.45 81.75 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . 0.446 ' O ' HD12 ' A' ' 554' ' ' LEU . 4.1 ttp180 -57.13 -52.99 63.08 Favored 'General case' 0 CA--C 1.51 -0.573 0 CA-C-O 117.995 -1.002 . . . . 0.0 109.731 179.62 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -50.19 -54.05 23.62 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 124.725 1.21 . . . . 0.0 108.748 178.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 15.1 tt0 -58.3 -39.26 78.86 Favored 'General case' 0 C--O 1.219 -0.501 0 CA-C-O 117.832 -1.08 . . . . 0.0 109.832 179.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -57.43 -39.1 75.48 Favored 'General case' 0 CA--C 1.514 -0.429 0 CA-C-N 120.031 1.287 . . . . 0.0 112.629 179.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.738 ' HB3' HD11 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -65.38 -51.9 57.26 Favored 'General case' 0 N--CA 1.454 -0.251 0 N-CA-C 108.03 -1.1 . . . . 0.0 108.03 176.248 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . 0.464 HD13 HD13 ' A' ' 571' ' ' LEU . 28.2 mm -65.65 -36.28 77.24 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 CA-C-O 123.528 1.632 . . . . 0.0 113.115 -179.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -59.84 -28.58 67.61 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 120.519 -1.363 . . . . 0.0 109.973 174.386 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -101.01 14.0 33.37 Favored 'General case' 0 CA--C 1.509 -0.63 0 C-N-CA 125.047 1.339 . . . . 0.0 110.983 176.043 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . 0.523 ' HG3' HD11 ' A' ' 563' ' ' LEU . 19.1 tt0 -100.64 -41.68 6.83 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 118.987 0.812 . . . . 0.0 109.182 176.981 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 13.6 ttp-105 -79.48 -14.76 58.68 Favored 'General case' 0 C--N 1.332 -0.19 0 O-C-N 121.316 -0.865 . . . . 0.0 111.169 178.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 72.3 p -101.11 -88.51 0.37 Allowed 'General case' 0 N--CA 1.441 -0.885 0 N-CA-C 107.932 -1.136 . . . . 0.0 107.932 -174.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -68.07 -51.27 48.51 Favored 'General case' 0 N--CA 1.435 -1.179 0 O-C-N 125.184 1.552 . . . . 0.0 108.312 -178.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 89.76 79.49 1.34 Allowed Glycine 0 CA--C 1.525 0.681 0 C-N-CA 125.609 1.576 . . . . 0.0 109.243 -176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.523 HD11 ' HG3' ' A' ' 558' ' ' GLU . 0.2 OUTLIER -41.21 159.34 0.02 OUTLIER 'General case' 0 C--N 1.346 0.431 0 C-N-CA 127.012 2.125 . . . . 0.0 110.867 172.746 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.1 p -59.4 163.02 4.27 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-O 122.439 1.114 . . . . 0.0 109.776 -175.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . 0.509 ' O ' HD23 ' A' ' 569' ' ' LEU . 0.7 OUTLIER -54.96 -42.16 72.02 Favored 'General case' 0 C--N 1.328 -0.346 0 O-C-N 121.499 -0.751 . . . . 0.0 110.742 173.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.4 mt-10 -62.59 -46.74 86.94 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 124.365 1.066 . . . . 0.0 110.102 178.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -64.26 -34.21 77.59 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.178 0.513 . . . . 0.0 111.051 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.62 -37.96 88.05 Favored 'General case' 0 CA--C 1.517 -0.296 0 O-C-N 121.165 -0.96 . . . . 0.0 110.64 176.13 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . 0.509 HD23 ' O ' ' A' ' 565' ' ' ASN . 3.8 mm? -67.48 -44.34 78.77 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-O 117.657 -1.163 . . . . 0.0 108.905 178.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.3 tp10 -52.72 -37.11 58.61 Favored 'General case' 0 C--O 1.223 -0.332 0 CA-C-N 118.768 0.713 . . . . 0.0 110.52 179.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.738 HD11 ' HB3' ' A' ' 554' ' ' LEU . 2.1 mt -60.51 -51.54 69.0 Favored 'General case' 0 CA--C 1.493 -1.238 0 CA-C-O 115.57 -2.157 . . . . 0.0 112.154 174.414 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.422 ' HD1' HD13 ' A' ' 569' ' ' LEU . 0.0 OUTLIER -45.97 -49.94 15.33 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-N 121.621 2.009 . . . . 0.0 109.536 174.855 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.95 -32.63 74.44 Favored 'General case' 0 C--O 1.218 -0.579 0 C-N-CA 125.192 1.397 . . . . 0.0 110.628 -177.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.555 ' CD1' HD12 ' A' ' 578' ' ' LEU . 1.7 tm? -76.43 -43.05 41.88 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.532 1.133 . . . . 0.0 109.255 174.745 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -59.46 -46.53 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 O-C-N 119.253 -2.155 . . . . 0.0 108.6 -176.221 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -33.99 71.76 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-O 117.86 -1.067 . . . . 0.0 110.808 174.114 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.03 -44.08 81.17 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 126.093 1.757 . . . . 0.0 107.89 -175.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.555 HD12 ' CD1' ' A' ' 574' ' ' LEU . 13.0 mt -82.18 -25.52 34.21 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-N 116.603 -0.271 . . . . 0.0 111.545 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 67.25 -53.05 0.48 Allowed 'General case' 0 C--O 1.238 0.487 0 C-N-CA 129.38 3.072 . . . . 0.0 112.009 -175.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -159.77 110.53 1.94 Allowed 'General case' 0 N--CA 1.435 -1.224 0 C-N-CA 124.982 1.313 . . . . 0.0 108.662 178.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-O 115.342 -2.266 . . . . 0.0 113.879 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 105.91 166.46 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.785 1 C-N-CA 134.755 5.222 . . . . 0.0 102.908 -172.644 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . 0.251 17.8 m 53.01 136.55 0.0 OUTLIER 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 127.675 2.39 . . . . 0.0 114.921 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . 0.518 HG22 ' H ' ' A' ' 452' ' ' ARG . 86.3 m -152.54 152.74 32.24 Favored 'General case' 0 N--CA 1.454 -0.231 0 O-C-N 118.54 -2.6 . . . . 0.0 108.327 -178.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -54.02 -25.83 23.21 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.386 1.074 . . . . 0.0 113.175 174.248 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . 0.518 ' H ' HG22 ' A' ' 450' ' ' THR . 5.5 mpt_? -65.76 -39.17 90.77 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 116.762 -1.589 . . . . 0.0 111.692 173.905 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 5.8 mm -61.27 -53.18 52.38 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.455 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 176.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 13.6 mt -60.07 -45.75 91.86 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 119.458 1.026 . . . . 0.0 111.282 -175.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . . . . . . . . . 60.3 mt -66.55 -54.06 29.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 CA-C-O 118.801 -0.619 . . . . 0.0 109.74 179.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -60.8 -32.1 78.08 Favored Glycine 0 CA--C 1.526 0.746 0 CA-C-N 119.741 1.155 . . . . 0.0 112.538 -175.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 83.6 mt -69.29 -47.83 63.42 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 117.677 0.739 . . . . 0.0 109.392 173.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -59.9 -28.05 67.24 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 123.489 0.715 . . . . 0.0 111.001 174.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 40.0 t -68.33 -57.23 9.79 Favored 'Isoleucine or valine' 0 C--N 1.341 0.197 0 O-C-N 121.047 -1.033 . . . . 0.0 108.959 173.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.56 -18.48 61.62 Favored 'General case' 0 N--CA 1.45 -0.429 0 O-C-N 121.735 -0.603 . . . . 0.0 111.665 -174.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . . . . . . . . . 36.1 t-20 -142.53 83.41 11.92 Favored Pre-proline 0 CA--C 1.54 0.57 0 C-N-CA 126.483 1.913 . . . . 0.0 109.623 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . . . . . . . . . 63.0 Cg_endo -70.79 -13.63 32.24 Favored 'Trans proline' 0 N--CA 1.459 -0.516 0 C-N-CA 121.264 1.309 . . . . 0.0 112.975 -179.109 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 8.0 mt-10 -68.51 -14.26 62.88 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 119.755 1.161 . . . . 0.0 110.464 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . . . . . . . . . 67.0 mt -63.4 -13.6 41.45 Favored 'General case' 0 CA--C 1.539 0.531 0 O-C-N 121.157 -0.965 . . . . 0.0 109.584 173.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . . . . . . . . . . . -64.41 -24.31 67.59 Favored 'General case' 0 CA--C 1.535 0.368 0 O-C-N 121.121 -0.987 . . . . 0.0 110.929 173.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 87.8 m -83.64 -13.99 52.95 Favored 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 119.234 0.924 . . . . 0.0 110.908 173.527 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.7 mt -94.8 -14.22 24.88 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.333 1.053 . . . . 0.0 112.047 179.132 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 489' ' ' VAL . 9.5 p -91.21 142.83 27.55 Favored Pre-proline 0 CA--C 1.546 0.819 0 CA-C-N 120.411 1.459 . . . . 0.0 108.869 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -68.61 170.67 14.63 Favored 'Trans proline' 0 CA--C 1.543 0.952 0 C-N-CA 121.848 1.699 . . . . 0.0 112.294 176.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.05 13.07 0.15 Allowed 'Trans proline' 0 CA--C 1.554 1.512 0 C-N-CA 124.924 3.749 . . . . 0.0 115.213 176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.4 ' HA ' HD23 ' A' ' 474' ' ' LEU . 1.5 mm? 72.08 46.01 0.36 Allowed 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 128.668 2.787 . . . . 0.0 113.359 173.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 6.7 tp10 -66.39 -83.32 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.714 2.005 . . . . 0.0 111.694 179.136 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.6 t-20 -70.13 -2.38 12.82 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 119.882 -1.761 . . . . 0.0 113.48 -176.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.439 HD21 ' CZ ' ' A' ' 543' ' ' PHE . 4.1 mm? -74.8 -76.62 0.14 Allowed 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 126.256 1.823 . . . . 0.0 108.214 -175.08 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 57.1 t0 62.25 131.71 0.01 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 124.139 1.923 . . . . 0.0 113.042 -177.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -63.47 -20.32 65.48 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 125.995 1.718 . . . . 0.0 110.394 177.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 32.7 t30 -73.08 -33.5 65.66 Favored 'General case' 0 N--CA 1.435 -1.196 0 C-N-CA 124.731 1.212 . . . . 0.0 110.456 174.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 71.0 mttt -80.67 -39.35 27.42 Favored 'General case' 0 C--N 1.352 0.678 0 CA-C-N 120.418 1.463 . . . . 0.0 111.812 179.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.589 HD21 HD11 ' A' ' 546' ' ' LEU . 1.5 mm? -119.09 118.22 32.94 Favored Pre-proline 0 CA--C 1.536 0.437 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 -179.391 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -68.96 2.74 2.84 Favored 'Trans proline' 0 CA--C 1.542 0.915 0 C-N-CA 122.136 1.891 . . . . 0.0 113.576 177.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -114.9 0.63 22.94 Favored Glycine 0 CA--C 1.526 0.721 0 CA-C-O 118.064 -1.409 . . . . 0.0 111.892 174.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 0.426 ' HB2' ' HB2' ' A' ' 479' ' ' LEU . 0.3 OUTLIER -63.48 -47.91 79.84 Favored 'General case' 0 C--O 1.212 -0.872 0 CA-C-N 119.158 1.479 . . . . 0.0 108.138 176.744 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -51.53 -49.37 46.27 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 118.765 0.711 . . . . 0.0 112.116 -176.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.43 -47.29 86.72 Favored 'General case' 0 CA--C 1.539 0.556 0 O-C-N 121.695 -0.886 . . . . 0.0 110.732 177.863 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -65.1 -39.55 93.31 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.249 0.62 . . . . 0.0 111.214 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 25.1 ttt180 -60.75 -53.22 60.05 Favored 'General case' 0 CA--C 1.507 -0.677 0 C-N-CA 126.544 1.938 . . . . 0.0 108.378 176.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 4.4 tp10 -58.45 -40.99 84.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 O-C-N 123.857 0.723 . . . . 0.0 110.04 -177.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 516' ' ' LEU . 0.9 OUTLIER -56.14 -57.5 11.9 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 122.99 0.516 . . . . 0.0 111.704 174.337 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.416 HG11 HG11 ' A' ' 468' ' ' VAL . 72.8 t -60.09 -43.8 93.63 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.318 0 C-N-CA 123.859 0.864 . . . . 0.0 110.205 -179.38 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 66.4 t30 -57.59 -49.47 76.3 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 126.321 1.848 . . . . 0.0 109.245 -178.969 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 96.7 m -58.95 -42.34 89.58 Favored 'General case' 0 N--CA 1.447 -0.579 0 C-N-CA 124.861 1.264 . . . . 0.0 110.758 174.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.92 -45.0 87.69 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-N 118.524 0.602 . . . . 0.0 109.802 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.89 -23.01 67.14 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.912 0.885 . . . . 0.0 112.226 174.305 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 6.1 t -86.28 -11.63 51.73 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.247 1.819 . . . . 0.0 113.45 179.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 75.7 mm-40 -133.22 75.47 70.84 Favored Pre-proline 0 CA--C 1.537 0.463 0 C-N-CA 126.19 1.796 . . . . 0.0 108.6 -178.519 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 58.2 Cg_endo -65.69 125.27 14.03 Favored 'Trans proline' 0 N--CA 1.455 -0.779 0 C-N-CA 121.643 1.562 . . . . 0.0 109.586 -178.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 93.77 9.44 59.84 Favored Glycine 0 CA--C 1.536 1.383 0 CA-C-O 119.261 -0.744 . . . . 0.0 113.169 -175.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . . . . . . . . . 1.7 tt -62.44 155.14 26.24 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 118.842 1.321 . . . . 0.0 108.24 173.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . 0.5 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 1.1 p -127.21 169.8 13.09 Favored 'General case' 0 N--CA 1.462 0.164 0 C-N-CA 123.85 0.86 . . . . 0.0 110.003 -173.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.1 m -50.01 -51.77 39.3 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.323 1.449 . . . . 0.0 109.962 173.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -77.22 -38.71 28.81 Favored Glycine 0 C--N 1.341 0.854 0 N-CA-C 110.762 -0.935 . . . . 0.0 110.762 -175.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.5 ' HB3' ' H ' ' A' ' 499' ' ' THR . 9.0 tp-100 -63.93 -25.77 68.29 Favored 'General case' 0 C--O 1.222 -0.392 0 CA-C-O 118.73 -0.652 . . . . 0.0 110.728 179.024 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 18.7 tp -63.48 -44.4 94.53 Favored 'General case' 0 CA--C 1.522 -0.119 0 CA-C-N 119.417 1.008 . . . . 0.0 111.014 175.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.424 HD11 ' HB2' ' A' ' 520' ' ' SER . 10.0 mp -65.57 -40.8 93.18 Favored 'General case' 0 C--O 1.231 0.097 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.11 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -63.7 -38.3 90.58 Favored 'General case' 0 CA--C 1.544 0.728 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 175.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 24.8 t60 -70.91 -20.67 62.46 Favored 'General case' 0 CA--C 1.535 0.392 0 O-C-N 121.092 -1.005 . . . . 0.0 112.947 -179.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 -106.72 11.94 29.73 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 124.464 1.106 . . . . 0.0 109.682 174.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 52.0 ttt180 -56.52 128.71 37.5 Favored 'General case' 0 CA--C 1.529 0.144 0 O-C-N 120.33 -1.481 . . . . 0.0 111.005 -174.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 84.23 5.93 86.81 Favored Glycine 0 CA--C 1.535 1.291 0 CA-C-O 118.495 -1.17 . . . . 0.0 113.502 179.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.838 HG22 ' H ' ' A' ' 512' ' ' ASN . 52.6 m -93.93 147.18 23.34 Favored 'General case' 0 N--CA 1.455 -0.199 0 CA-C-N 119.59 1.695 . . . . 0.0 107.382 -174.508 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 72.7 m-20 -59.4 -17.71 32.75 Favored 'General case' 0 C--O 1.214 -0.769 0 O-C-N 120.691 -1.256 . . . . 0.0 113.328 175.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.838 ' H ' HG22 ' A' ' 510' ' ' THR . 7.5 m-80 -92.96 -19.47 21.58 Favored 'General case' 0 CA--C 1.547 0.851 0 CA-C-O 117.756 -1.116 . . . . 0.0 110.973 177.469 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -46.27 -50.09 16.54 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 118.474 -0.774 . . . . 0.0 111.64 175.866 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -51.88 -45.3 64.08 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 0.0 112.178 179.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 25.8 m -58.42 -49.66 76.48 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-O 118.972 -0.537 . . . . 0.0 110.669 173.37 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.485 HD21 HD21 ' A' ' 488' ' ' LEU . 35.1 mt -67.6 -35.76 79.59 Favored 'General case' 0 C--O 1.222 -0.379 0 C-N-CA 123.788 0.835 . . . . 0.0 111.516 -176.968 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -62.13 -47.61 83.81 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 126.911 2.084 . . . . 0.0 107.611 176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 7.2 tttt -61.26 -29.88 70.11 Favored 'General case' 0 N--CA 1.455 -0.193 0 CA-C-O 117.509 -1.234 . . . . 0.0 112.213 174.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 81.8 mt -89.44 -10.86 44.83 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 119.51 1.05 . . . . 0.0 112.263 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . 0.424 ' HB2' HD11 ' A' ' 504' ' ' LEU . 18.3 t -77.64 -54.08 6.81 Favored 'General case' 0 C--O 1.225 -0.194 0 C-N-CA 125.454 1.502 . . . . 0.0 109.819 174.047 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.78 19.1 1.76 Allowed 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.751 1.221 . . . . 0.0 112.571 -178.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 3.4 t90 -74.95 102.23 4.72 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 116.816 2.154 . . . . 0.0 116.816 -172.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -70.28 -3.74 18.65 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 129.755 3.222 . . . . 0.0 113.693 178.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -77.91 -20.39 52.96 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 121.138 -0.976 . . . . 0.0 111.379 -177.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 1.8 pt -127.12 -63.28 1.11 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.368 0 C-N-CA 126.01 1.724 . . . . 0.0 109.701 177.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 46.27 25.12 0.33 Allowed 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 126.807 2.043 . . . . 0.0 115.889 176.922 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -126.23 177.11 6.61 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 125.036 1.335 . . . . 0.0 109.367 -175.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.32 -21.66 2.29 Favored 'General case' 0 N--CA 1.469 0.481 0 C-N-CA 125.32 1.448 . . . . 0.0 112.982 179.618 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -88.22 -56.95 3.11 Favored 'General case' 0 CA--C 1.52 -0.203 0 C-N-CA 126.751 2.02 . . . . 0.0 108.036 174.403 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 43.1 mt -58.51 -31.37 43.31 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.332 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 174.264 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -51.32 -54.17 28.76 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-N 118.651 0.66 . . . . 0.0 112.251 176.094 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -64.77 -45.98 84.07 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.312 0.505 . . . . 0.0 109.91 -177.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -60.15 -44.74 94.74 Favored 'General case' 0 C--O 1.231 0.107 0 C-N-CA 123.108 0.563 . . . . 0.0 110.972 -179.175 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 96.8 m -69.1 -30.81 69.18 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 117.812 -1.089 . . . . 0.0 110.503 176.049 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -62.13 -55.15 31.7 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 120.879 1.672 . . . . 0.0 108.698 174.404 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 74.6 m -60.36 -41.41 93.63 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-O 118.805 -0.617 . . . . 0.0 111.055 -179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -64.97 -47.32 78.01 Favored 'General case' 0 N--CA 1.473 0.706 0 CA-C-N 118.919 0.781 . . . . 0.0 111.929 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 46.5 t -61.21 -50.01 74.81 Favored 'General case' 0 C--O 1.232 0.18 0 C-N-CA 125.499 1.52 . . . . 0.0 111.536 177.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.0 tt -55.42 -49.48 72.3 Favored 'General case' 0 C--N 1.333 -0.125 0 C-N-CA 125.152 1.381 . . . . 0.0 110.138 175.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -58.62 -46.08 87.82 Favored 'General case' 0 N--CA 1.449 -0.519 0 CA-C-O 118.193 -0.908 . . . . 0.0 109.735 178.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -62.34 -40.29 95.89 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-N 119.313 0.961 . . . . 0.0 110.667 178.966 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.64 -52.73 64.45 Favored 'General case' 0 N--CA 1.453 -0.308 0 N-CA-C 108.689 -0.856 . . . . 0.0 108.689 176.656 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.439 ' CZ ' HD21 ' A' ' 474' ' ' LEU . 4.5 m-85 -63.22 -45.6 90.9 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.671 0.788 . . . . 0.0 111.296 -177.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -52.46 -49.04 65.44 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 127.764 2.426 . . . . 0.0 109.477 175.583 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 10.7 t -60.7 -41.36 95.03 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 123.146 0.579 . . . . 0.0 111.9 175.644 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.589 HD11 HD21 ' A' ' 479' ' ' LEU . 86.5 mt -67.76 -34.74 77.41 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 120.681 -1.262 . . . . 0.0 110.788 178.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 574' ' ' LEU . 77.8 mt -70.82 -39.72 72.86 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 125.271 1.428 . . . . 0.0 110.551 176.141 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -64.06 -48.01 77.89 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 125.231 1.412 . . . . 0.0 108.865 175.075 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 42.0 mt -57.6 -48.03 80.53 Favored 'General case' 0 C--N 1.338 0.1 0 C-N-CA 123.473 0.709 . . . . 0.0 109.575 175.226 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 41.6 ttt85 -62.26 -42.04 98.98 Favored 'General case' 0 N--CA 1.462 0.129 0 CA-C-O 118.308 -0.853 . . . . 0.0 110.739 179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -55.41 -50.08 70.69 Favored 'General case' 0 C--O 1.231 0.123 0 CA-C-O 118.604 -0.713 . . . . 0.0 110.104 173.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -63.66 -38.16 90.07 Favored 'General case' 0 C--O 1.225 -0.216 0 CA-C-N 119.448 1.022 . . . . 0.0 109.549 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -66.36 -35.89 81.5 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.267 0.556 . . . . 0.0 110.202 -176.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.511 HD12 ' C ' ' A' ' 554' ' ' LEU 0.282 0.2 OUTLIER -77.15 -39.64 48.43 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 124.332 1.053 . . . . 0.0 111.028 176.991 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 26.1 mm -66.59 -33.16 61.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-N 120.965 1.711 . . . . 0.0 108.791 173.482 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -61.18 -32.05 71.79 Favored 'General case' 0 C--O 1.237 0.406 0 O-C-N 120.296 -1.503 . . . . 0.0 110.045 -179.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 13.3 mtp-105 -74.01 -8.24 55.38 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 117.043 -1.456 . . . . 0.0 111.957 173.35 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -76.37 -61.82 1.82 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-N 123.144 2.702 . . . . 0.0 111.77 174.188 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 52.3 ttt85 -68.04 -18.66 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 118.748 -0.644 . . . . 0.0 112.108 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 75.1 p -95.98 -88.52 0.27 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 27.9 m80 -66.7 -56.93 8.35 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 124.575 1.15 . . . . 0.0 112.343 -178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 127.21 121.26 2.42 Favored Glycine 0 CA--C 1.534 1.238 0 C-N-CA 125.542 1.544 . . . . 0.0 110.557 -174.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . . . . . . . . . 10.4 mt -75.93 150.9 37.43 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 118.442 1.121 . . . . 0.0 112.013 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 35.4 t -78.14 164.59 24.84 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 125.789 1.635 . . . . 0.0 108.231 173.391 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -62.96 -42.04 99.71 Favored 'General case' 0 C--O 1.226 -0.164 0 N-CA-C 108.82 -0.807 . . . . 0.0 108.82 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -69.64 -50.43 44.28 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 108.49 -0.929 . . . . 0.0 108.49 -176.274 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -60.49 -33.82 73.15 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.86 -0.525 . . . . 0.0 111.382 179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . 0.512 ' HA ' HD12 ' A' ' 571' ' ' LEU . 52.9 ttt85 -66.22 -34.21 77.5 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 121.301 -0.875 . . . . 0.0 109.974 175.69 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 80.9 mt -73.09 -34.33 66.14 Favored 'General case' 0 N--CA 1.469 0.492 0 CA-C-O 117.177 -1.392 . . . . 0.0 110.638 175.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 4.2 tp10 -53.92 -36.43 62.74 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-N 119.328 0.967 . . . . 0.0 109.305 176.337 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.512 HD12 ' HA ' ' A' ' 568' ' ' ARG . 6.3 mt -61.71 -39.32 91.08 Favored 'General case' 0 CA--C 1.519 -0.222 0 O-C-N 120.822 -1.174 . . . . 0.0 112.426 175.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.1 OUTLIER -59.93 -45.88 91.17 Favored 'General case' 0 N--CA 1.45 -0.428 0 CA-C-N 121.037 1.744 . . . . 0.0 108.148 176.477 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 3.7 m -66.37 -49.55 66.5 Favored 'General case' 0 CA--C 1.538 0.497 0 O-C-N 123.81 0.694 . . . . 0.0 109.285 -174.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.408 HD11 HD22 ' A' ' 547' ' ' LEU . 6.2 tp -55.1 -43.35 73.91 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 126.171 1.788 . . . . 0.0 111.286 175.123 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 6.7 m-80 -64.56 -39.34 93.57 Favored 'General case' 0 C--N 1.342 0.255 0 CA-C-O 119.1 -0.476 . . . . 0.0 110.903 -179.517 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -73.37 -34.15 65.42 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-O 118.277 -0.868 . . . . 0.0 110.649 178.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -67.04 -37.19 83.65 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 119.407 1.003 . . . . 0.0 109.469 176.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.0 mt -76.91 -20.83 55.72 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 120.487 -1.383 . . . . 0.0 109.718 -178.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . -74.03 -32.52 63.38 Favored 'General case' 0 CA--C 1.538 0.514 0 O-C-N 121.518 -0.738 . . . . 0.0 111.359 175.565 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 11.3 mtpp -115.88 81.31 1.58 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 120.054 1.297 . . . . 0.0 110.84 -178.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 173.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . 0.431 ' HE3' ' OD1' ' A' ' 537' ' ' ASP . 0.3 OUTLIER . . . . . 0 CA--C 1.544 0.738 0 N-CA-C 108.513 -0.921 . . . . 0.0 108.513 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 49.18 76.15 0.13 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 125.206 1.402 . . . . 0.0 110.752 -178.668 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 2.6 t -100.31 140.39 34.62 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 124.825 1.25 . . . . 0.0 109.085 177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 14.4 t -136.0 68.61 1.44 Allowed 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 -175.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . 0.501 ' O ' HD12 ' A' ' 455' ' ' ILE . 10.1 mtm 49.42 29.76 3.0 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.005 0.922 . . . . 0.0 111.626 -176.342 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 1.6 mtm180 -112.06 -55.12 2.55 Favored 'General case' 0 C--O 1.216 -0.695 0 C-N-CA 124.698 1.199 . . . . 0.0 108.464 -176.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . . . . . . . . . 19.7 mm -56.76 -46.81 83.33 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.716 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 176.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -54.51 -55.12 32.35 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.378 0.99 . . . . 0.0 110.356 -178.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 1.088 HD13 HD23 ' A' ' 484' ' ' LEU . 23.2 mt -65.34 -49.04 80.86 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.753 0 CA-C-O 118.931 -0.557 . . . . 0.0 110.933 -179.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -61.2 -38.88 96.35 Favored Glycine 0 N--CA 1.449 -0.472 0 C-N-CA 124.048 0.833 . . . . 0.0 111.929 -173.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.568 HD22 ' HB1' ' A' ' 531' ' ' ALA . 52.1 mt -66.37 -45.15 81.06 Favored 'General case' 0 N--CA 1.439 -1.01 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 173.723 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.67 -34.45 71.26 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 123.99 0.916 . . . . 0.0 111.871 174.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 19.7 t -61.23 -53.9 42.61 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.439 0 C-N-CA 124.913 1.285 . . . . 0.0 109.942 177.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -80.63 -20.94 42.02 Favored 'General case' 0 C--O 1.235 0.317 0 O-C-N 122.141 -0.35 . . . . 0.0 111.32 -179.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.584 ' HB3' HD12 ' A' ' 464' ' ' LEU . 17.7 t-20 -130.07 81.05 69.75 Favored Pre-proline 0 C--N 1.323 -0.549 0 C-N-CA 124.001 0.921 . . . . 0.0 108.993 -173.626 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . 0.423 ' HB3' HD23 ' A' ' 498' ' ' LEU . 36.2 Cg_endo -64.56 -22.54 64.93 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 121.994 1.796 . . . . 0.0 111.21 -179.147 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -70.16 -22.58 62.96 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.155 0.982 . . . . 0.0 110.686 176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.584 HD12 ' HB3' ' A' ' 461' ' ' ASN . 38.8 mt -63.67 -12.11 31.3 Favored 'General case' 0 CA--C 1.538 0.508 0 O-C-N 120.7 -1.25 . . . . 0.0 111.362 173.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.478 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -66.76 -28.05 68.09 Favored 'General case' 0 C--O 1.223 -0.294 0 O-C-N 120.907 -1.12 . . . . 0.0 111.209 174.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 31.9 m -83.65 -21.83 32.34 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.904 0.882 . . . . 0.0 110.906 173.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.66 -14.8 47.48 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 118.777 0.717 . . . . 0.0 112.773 175.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 489' ' ' VAL . 5.7 p -77.79 145.48 70.66 Favored Pre-proline 0 CA--C 1.546 0.825 0 CA-C-N 120.166 1.348 . . . . 0.0 109.21 176.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.556 ' HD2' HD11 ' A' ' 539' ' ' LEU . 13.3 Cg_endo -68.67 170.43 15.24 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.513 2.809 . . . . 0.0 111.483 173.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -74.46 12.92 0.99 Allowed 'Trans proline' 0 CA--C 1.547 1.129 0 C-N-CA 123.413 2.742 . . . . 0.0 114.277 175.706 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.639 ' HG ' HD12 ' A' ' 474' ' ' LEU . 6.6 mp 72.46 43.07 0.5 Allowed 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 127.153 2.181 . . . . 0.0 112.698 174.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -65.81 -30.76 71.44 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -176.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 4.6 m-80 -126.06 17.41 7.85 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 125.566 1.546 . . . . 0.0 110.536 -178.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.639 HD12 ' HG ' ' A' ' 471' ' ' LEU . 61.3 mt -100.85 -101.68 0.25 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.246 1.019 . . . . 0.0 109.173 178.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 47.3 t0 70.97 147.15 0.07 Allowed 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 128.141 2.577 . . . . 0.0 109.979 -173.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.85 -25.85 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 125.844 1.658 . . . . 0.0 109.622 173.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -59.16 -33.55 71.04 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 122.969 0.508 . . . . 0.0 111.229 175.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.417 ' HB3' HD22 ' A' ' 546' ' ' LEU . 54.9 mttt -92.38 -24.33 18.93 Favored 'General case' 0 C--N 1.342 0.274 0 N-CA-C 112.26 0.466 . . . . 0.0 112.26 176.772 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 546' ' ' LEU . 0.9 OUTLIER -125.84 96.15 38.36 Favored Pre-proline 0 C--O 1.236 0.35 0 N-CA-C 108.676 -0.861 . . . . 0.0 108.676 -177.015 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -73.16 67.31 4.22 Favored 'Trans proline' 0 N--CA 1.451 -1.029 0 C-N-CA 123.579 2.852 . . . . 0.0 111.394 -174.497 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . 163.52 -23.33 0.18 Allowed Glycine 0 CA--C 1.533 1.216 0 C-N-CA 127.019 2.247 . . . . 0.0 112.308 -175.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . . . . . . . . . 4.1 tp -60.66 -23.98 65.23 Favored 'General case' 0 CA--C 1.514 -0.434 0 O-C-N 121.633 -0.922 . . . . 0.0 110.814 -179.523 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -49.07 -35.26 18.46 Favored Glycine 0 C--O 1.222 -0.655 0 CA-C-N 119.136 0.88 . . . . 0.0 111.326 174.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . 1.088 HD23 HD13 ' A' ' 455' ' ' ILE . 6.4 tp -61.16 -43.44 98.87 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 118.72 1.26 . . . . 0.0 111.337 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . . . . . . . . . 21.4 t80 -65.33 -51.25 61.84 Favored 'General case' 0 CA--C 1.516 -0.336 0 C-N-CA 124.572 1.149 . . . . 0.0 110.845 176.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -53.84 -50.6 65.85 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 -179.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.02 -38.96 86.87 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-N 118.596 0.634 . . . . 0.0 111.12 -178.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.73 -50.91 69.09 Favored 'General case' 0 N--CA 1.454 -0.231 0 CA-C-N 117.851 0.296 . . . . 0.0 110.964 174.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.675 HG11 HG11 ' A' ' 468' ' ' VAL . 73.9 t -62.1 -45.61 98.35 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 118.416 -0.802 . . . . 0.0 109.264 176.367 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -55.61 -46.37 77.34 Favored 'General case' 0 N--CA 1.464 0.269 0 C-N-CA 124.324 1.05 . . . . 0.0 109.353 -176.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 95.5 m -61.67 -46.77 88.29 Favored 'General case' 0 N--CA 1.446 -0.661 0 C-N-CA 127.178 2.191 . . . . 0.0 110.654 174.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . . . . . . . . . 69.4 m -63.14 -44.16 96.33 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.155 0.889 . . . . 0.0 110.321 -178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -23.18 64.69 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.105 1.362 . . . . 0.0 112.085 174.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -82.28 -51.23 8.11 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.169 1.388 . . . . 0.0 110.293 177.397 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -71.3 100.48 0.3 Allowed Pre-proline 0 CA--C 1.55 0.956 0 C-N-CA 127.062 2.145 . . . . 0.0 110.504 -173.884 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -73.43 115.01 4.19 Favored 'Trans proline' 0 N--CA 1.453 -0.882 0 C-N-CA 123.287 2.658 . . . . 0.0 111.574 -173.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 74.58 34.01 54.76 Favored Glycine 0 CA--C 1.522 0.478 0 CA-C-N 114.935 -1.029 . . . . 0.0 111.252 -178.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.633 HD21 HD13 ' A' ' 503' ' ' LEU . 15.9 tp -54.74 154.43 5.06 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.643 0.735 . . . . 0.0 110.242 174.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -130.96 163.98 26.34 Favored 'General case' 0 CA--C 1.532 0.258 0 C-N-CA 125.2 1.4 . . . . 0.0 108.565 179.347 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -52.76 -45.32 67.01 Favored 'General case' 0 N--CA 1.47 0.565 0 C-N-CA 123.911 0.884 . . . . 0.0 110.583 175.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -80.24 -31.96 36.62 Favored Glycine 0 C--N 1.338 0.691 0 CA-C-O 118.899 -0.945 . . . . 0.0 111.081 -176.51 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.15 -40.24 95.71 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-N 118.363 1.081 . . . . 0.0 108.751 174.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.633 HD13 HD21 ' A' ' 498' ' ' LEU . 16.5 tp -52.93 -53.08 54.75 Favored 'General case' 0 N--CA 1.454 -0.256 0 CA-C-N 118.906 0.776 . . . . 0.0 109.562 177.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . . . . . . . . . 15.6 mt -58.69 -40.72 84.42 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 118.102 0.41 . . . . 0.0 111.661 176.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 7.8 tt0 -63.14 -40.14 96.72 Favored 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 122.759 0.423 . . . . 0.0 111.078 179.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -67.4 -20.57 65.55 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 125.359 1.464 . . . . 0.0 111.646 179.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . 0.525 ' O ' ' HB2' ' A' ' 513' ' ' ALA . 66.5 m-85 -108.15 17.54 22.17 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 125.695 1.598 . . . . 0.0 109.217 176.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 15.5 ttt180 -59.7 133.88 56.5 Favored 'General case' 0 N--CA 1.454 -0.243 0 O-C-N 119.901 -1.749 . . . . 0.0 110.166 -175.52 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 63.43 18.71 61.38 Favored Glycine 0 CA--C 1.532 1.099 0 O-C-N 121.712 -0.618 . . . . 0.0 113.256 -179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.811 HG22 ' H ' ' A' ' 512' ' ' ASN . 44.7 m -93.12 140.79 29.13 Favored 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 106.756 -1.572 . . . . 0.0 106.756 -178.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -56.01 -20.45 16.73 Favored 'General case' 0 C--O 1.209 -1.033 0 N-CA-C 113.34 0.867 . . . . 0.0 113.34 178.359 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.811 ' H ' HG22 ' A' ' 510' ' ' THR . 1.1 m120 -94.16 -19.5 20.72 Favored 'General case' 0 C--O 1.238 0.45 0 C-N-CA 125.068 1.347 . . . . 0.0 109.715 -179.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 507' ' ' TYR . . . -47.98 -45.53 31.65 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 174.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -53.75 -43.81 69.44 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.949 1.3 . . . . 0.0 112.1 -178.402 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 22.5 m -62.85 -49.82 73.38 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 123.562 0.745 . . . . 0.0 109.042 173.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . . . . . . . . . 36.1 mt -62.16 -35.73 79.69 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.404 1.081 . . . . 0.0 112.558 -178.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.94 -34.29 62.07 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 127.583 2.353 . . . . 0.0 108.75 178.548 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 6.0 tptt -63.2 -43.31 98.51 Favored 'General case' 0 C--O 1.233 0.225 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 173.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . . . . . . . . . 24.4 mt -71.17 -22.39 62.05 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 124.548 1.139 . . . . 0.0 110.626 174.621 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 41.1 t -62.34 -53.99 46.99 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 120.744 1.611 . . . . 0.0 109.496 179.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -89.82 20.28 4.23 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.875 1.27 . . . . 0.0 111.397 -175.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . . . . . . . . . 4.9 t90 -70.57 126.76 30.52 Favored 'General case' 0 C--N 1.329 -0.322 0 C-N-CA 123.386 0.674 . . . . 0.0 111.324 -173.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -99.05 -2.45 37.14 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.06 1.344 . . . . 0.0 111.424 -174.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -68.74 -27.68 66.14 Favored 'General case' 0 N--CA 1.485 1.304 0 O-C-N 120.818 -1.176 . . . . 0.0 111.988 179.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -118.82 -67.32 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.458 -0.064 0 C-N-CA 126.026 1.731 . . . . 0.0 107.974 179.443 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 37.94 52.02 1.46 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 125.586 1.554 . . . . 0.0 112.14 -178.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -148.27 167.84 24.09 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.947 1.299 . . . . 0.0 109.464 177.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -120.63 -32.41 4.05 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 127.091 2.156 . . . . 0.0 111.597 177.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -83.38 -55.05 4.54 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 125.261 1.424 . . . . 0.0 109.413 179.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 53.5 mt -62.92 -25.89 39.59 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.197 0 N-CA-C 108.588 -0.893 . . . . 0.0 108.588 174.256 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.568 ' HB1' HD22 ' A' ' 457' ' ' LEU . . . -53.9 -54.03 44.35 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 118.547 -0.739 . . . . 0.0 111.134 174.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 19.4 tp10 -57.83 -46.03 85.34 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 122.19 0.995 . . . . 0.0 110.67 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -66.55 -46.92 74.49 Favored 'General case' 0 N--CA 1.455 -0.206 0 O-C-N 121.767 -0.583 . . . . 0.0 110.104 -177.472 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . . . . . . . . . 41.6 m -62.25 -28.05 69.44 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.513 1.525 . . . . 0.0 110.453 174.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.467 ' CD1' HD13 ' A' ' 464' ' ' LEU . 43.0 t80 -66.23 -57.66 7.08 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-N 120.957 1.708 . . . . 0.0 108.641 176.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 17.8 m -62.17 -39.21 91.9 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-O 118.779 -0.629 . . . . 0.0 110.346 -178.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . 0.431 ' OD1' ' HE3' ' A' ' 447' ' ' LYS . 34.4 t0 -63.91 -46.81 83.15 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 119.452 1.024 . . . . 0.0 111.758 177.507 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 29.3 t -65.72 -48.74 70.94 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 125.032 1.333 . . . . 0.0 110.59 177.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.556 HD11 ' HD2' ' A' ' 469' ' ' PRO . 2.4 tt -55.27 -52.4 63.54 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-O 117.544 -1.217 . . . . 0.0 109.031 176.53 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -59.99 -40.19 88.33 Favored 'General case' 0 C--O 1.214 -0.798 0 O-C-N 124.04 0.838 . . . . 0.0 109.927 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -66.34 -32.8 74.42 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.492 1.042 . . . . 0.0 110.395 177.359 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 2.3 ttm -66.92 -58.99 3.9 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.092 -1.077 . . . . 0.0 108.092 177.408 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.442 ' CD1' HD21 ' A' ' 474' ' ' LEU . 25.7 m-85 -57.88 -45.16 86.8 Favored 'General case' 0 C--O 1.222 -0.374 0 C-N-CA 124.906 1.283 . . . . 0.0 110.166 -178.684 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -55.6 -50.52 69.9 Favored 'General case' 0 C--O 1.22 -0.458 0 C-N-CA 126.245 1.818 . . . . 0.0 109.513 174.579 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 5.0 t -57.97 -42.09 84.29 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 118.552 0.615 . . . . 0.0 110.187 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.755 HD11 HD11 ' A' ' 479' ' ' LEU . 17.6 mt -72.57 -35.2 67.89 Favored 'General case' 0 CA--C 1.513 -0.468 0 CA-C-N 119.371 0.987 . . . . 0.0 110.519 -177.436 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 26.5 mt -67.95 -40.0 83.34 Favored 'General case' 0 N--CA 1.442 -0.86 0 CA-C-O 116.942 -1.504 . . . . 0.0 108.241 175.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -62.19 -58.33 8.17 Favored 'General case' 0 C--O 1.222 -0.356 0 C-N-CA 126.242 1.817 . . . . 0.0 108.379 174.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 17.2 mt -55.98 -54.83 40.04 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 125.768 1.627 . . . . 0.0 109.814 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.58 -49.85 76.16 Favored 'General case' 0 CA--C 1.509 -0.627 0 C-N-CA 124.88 1.272 . . . . 0.0 110.1 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . 0.427 ' O ' HD23 ' A' ' 554' ' ' LEU . 0.5 OUTLIER -49.59 -56.02 11.46 Favored 'General case' 0 N--CA 1.445 -0.681 0 CA-C-O 116.245 -1.836 . . . . 0.0 108.656 173.634 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 10.6 tt0 -60.3 -35.41 75.52 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 120.266 1.393 . . . . 0.0 109.956 -174.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.76 -44.81 88.86 Favored 'General case' 0 C--O 1.242 0.697 0 O-C-N 121.565 -0.709 . . . . 0.0 111.197 -179.841 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 571' ' ' LEU 0.267 0.0 OUTLIER -80.07 -44.81 19.4 Favored 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.944 -1.026 . . . . 0.0 110.372 177.689 . . . . . . . . 4 4 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -56.82 -39.6 65.58 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.897 0 CA-C-N 120.942 1.701 . . . . 0.0 108.043 179.176 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . 0.501 ' O ' HG22 ' A' ' 560' ' ' THR . . . -58.76 -39.43 80.95 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 120.636 -1.29 . . . . 0.0 109.759 177.326 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.51 -13.08 18.12 Favored 'General case' 0 C--O 1.212 -0.917 0 CA-C-O 116.014 -1.946 . . . . 0.0 110.01 176.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . 0.584 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.0 OUTLIER -72.47 -58.04 3.7 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 122.306 2.321 . . . . 0.0 109.256 173.574 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -63.59 -27.69 69.42 Favored 'General case' 0 CA--C 1.53 0.207 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -173.462 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . 0.502 HG23 ' H ' ' A' ' 561' ' ' HIS . 1.6 t -99.6 -82.4 0.44 Allowed 'General case' 0 N--CA 1.455 -0.212 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 179.992 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . 0.502 ' H ' HG23 ' A' ' 560' ' ' THR . 1.6 t-80 -58.48 -40.95 84.15 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 114.049 -1.432 . . . . 0.0 113.798 -173.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 98.21 119.29 4.01 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.22 -1.152 . . . . 0.0 110.22 -174.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.584 HD12 ' HB2' ' A' ' 558' ' ' GLU . 1.0 OUTLIER -92.75 152.48 19.46 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 107.543 -1.28 . . . . 0.0 107.543 173.431 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 1.2 t -73.05 165.09 25.69 Favored 'General case' 0 N--CA 1.44 -0.961 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 -177.539 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -58.01 -37.54 74.49 Favored 'General case' 0 N--CA 1.465 0.3 0 O-C-N 121.451 -0.781 . . . . 0.0 111.385 179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -75.61 -53.21 8.95 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 124.532 1.145 . . . . 0.0 110.648 179.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . 0.633 ' O ' HD22 ' A' ' 571' ' ' LEU . 0.9 OUTLIER -58.75 -40.43 83.82 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 118.96 0.8 . . . . 0.0 111.17 177.689 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 20.0 ttp180 -59.53 -33.61 71.6 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-N 120.138 1.335 . . . . 0.0 109.794 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 19.1 mt -72.36 -37.15 68.87 Favored 'General case' 0 C--O 1.224 -0.27 0 CA-C-O 116.715 -1.612 . . . . 0.0 110.068 174.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 3.1 tp10 -49.77 -41.1 43.39 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 120.841 1.655 . . . . 0.0 109.431 174.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 0.767 HD11 HD11 ' A' ' 554' ' ' LEU . 0.8 OUTLIER -68.86 -38.35 79.68 Favored 'General case' 0 C--N 1.342 0.256 0 CA-C-O 118.355 -0.831 . . . . 0.0 111.949 -177.801 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -54.78 -47.25 74.19 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 119.512 1.051 . . . . 0.0 109.018 173.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -62.01 -52.55 63.51 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 109.146 -0.687 . . . . 0.0 109.146 -179.62 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.412 HD22 ' HG3' ' A' ' 551' ' ' GLN . 7.1 tt -55.43 -36.44 66.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.284 1.434 . . . . 0.0 111.288 178.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -61.21 -39.76 91.45 Favored 'General case' 0 N--CA 1.474 0.741 0 O-C-N 120.155 -1.591 . . . . 0.0 111.474 176.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -78.41 -25.05 45.98 Favored 'General case' 0 CA--C 1.537 0.458 0 CA-C-O 118.637 -0.696 . . . . 0.0 110.857 175.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -66.99 -38.95 86.95 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.558 1.143 . . . . 0.0 109.503 176.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 17.0 mt -84.02 -9.92 58.28 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.882 1.273 . . . . 0.0 112.683 173.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 47.04 42.68 13.02 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.082 1.753 . . . . 0.0 114.577 178.234 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -143.75 127.16 16.83 Favored 'General case' 0 N--CA 1.467 0.419 0 O-C-N 120.865 -1.147 . . . . 0.0 109.819 178.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 32.5 mttp . . . . . 0 N--CA 1.471 0.603 0 C-N-CA 125.329 1.452 . . . . 0.0 110.288 177.169 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.457 -0.106 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' ARG . . . . . . . . . . . . . 10.4 tpp180 -150.92 -67.7 0.19 Allowed 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 105.246 -2.131 . . . . 0.0 105.246 173.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' THR . . . . . . . . . . . . . 30.7 m -90.8 89.47 7.5 Favored 'General case' 0 N--CA 1.444 -0.746 0 N-CA-C 106.815 -1.55 . . . . 0.0 106.815 -176.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' THR . . . . . . . . . . . . . 15.2 t -145.18 61.86 1.3 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.914 1.686 . . . . 0.0 108.3 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' MET . . . . . 0.728 ' HE1' HD12 ' A' ' 482' ' ' LEU . 53.2 tpp 46.29 51.65 11.22 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-O 123.711 1.72 . . . . 0.0 110.721 178.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -146.01 -51.29 0.23 Allowed 'General case' 0 CA--C 1.486 -1.491 0 CA-C-O 117.007 -1.473 . . . . 0.0 108.848 -175.159 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 534' ' ' THR . 7.4 mm -58.74 -52.6 58.11 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.689 0 O-C-N 124.946 1.404 . . . . 0.0 107.709 176.106 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . 0.435 ' HB3' ' CE1' ' A' ' 485' ' ' PHE . 2.7 mt -56.78 -47.13 80.87 Favored 'General case' 0 C--O 1.221 -0.409 0 CA-C-N 118.74 0.7 . . . . 0.0 110.75 -175.149 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' ILE . . . . . 0.403 HG22 HD13 ' A' ' 519' ' ' LEU . 26.5 mt -62.22 -59.31 4.54 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.873 0 C-N-CA 123.851 0.86 . . . . 0.0 111.606 174.296 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLY . . . . . . . . . . . . . . . -62.85 -38.14 96.04 Favored Glycine 0 CA--C 1.526 0.737 0 CA-C-N 120.833 1.651 . . . . 0.0 113.233 -173.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . 0.96 HD21 HG21 ' A' ' 525' ' ' ILE . 47.2 mt -68.9 -38.16 79.44 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-O 117.28 -1.343 . . . . 0.0 109.776 173.368 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' LEU . . . . . 0.539 HD11 ' SG ' ' A' ' 492' ' ' CYS . 2.6 tm? -65.96 -36.02 82.2 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 119.771 1.169 . . . . 0.0 109.86 173.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' VAL . . . . . . . . . . . . . 6.7 t -60.91 -51.6 71.31 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.325 0 O-C-N 120.561 -1.337 . . . . 0.0 109.041 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -77.25 -20.24 55.46 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 123.719 0.807 . . . . 0.0 112.067 177.413 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' ASN . . . . . 0.512 ' HB3' HD12 ' A' ' 464' ' ' LEU . 0.2 OUTLIER -134.53 74.69 65.2 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 119.031 0.832 . . . . 0.0 109.316 -178.968 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' PRO . . . . . 0.583 ' CB ' HD23 ' A' ' 498' ' ' LEU . 24.3 Cg_endo -68.31 -18.52 44.5 Favored 'Trans proline' 0 N--CA 1.459 -0.54 0 C-N-CA 121.575 1.516 . . . . 0.0 112.119 -175.163 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' GLU . . . . . . . . . . . . . 51.4 mm-40 -65.84 -15.06 62.55 Favored 'General case' 0 CA--C 1.555 1.141 0 C-N-CA 124.693 1.197 . . . . 0.0 110.857 173.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' LEU . . . . . 0.595 HD13 ' CD2' ' A' ' 535' ' ' PHE . 43.1 mt -70.31 -12.28 61.48 Favored 'General case' 0 C--N 1.348 0.533 0 O-C-N 120.437 -1.415 . . . . 0.0 109.01 173.509 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' ALA . . . . . 0.552 ' O ' HG12 ' A' ' 468' ' ' VAL . . . -58.82 -44.73 90.93 Favored 'General case' 0 N--CA 1.444 -0.764 0 CA-C-N 118.944 0.793 . . . . 0.0 109.195 173.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' THR . . . . . . . . . . . . . 99.6 m -70.3 -24.73 63.08 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 120.642 -1.286 . . . . 0.0 112.979 -179.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' LEU . . . . . . . . . . . . . 5.2 mt -83.92 -6.02 59.33 Favored 'General case' 0 C--O 1.232 0.181 0 C-N-CA 126.222 1.809 . . . . 0.0 111.393 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' VAL . . . . . 0.644 HG22 ' HD2' ' A' ' 469' ' ' PRO . 0.6 OUTLIER -93.82 157.87 37.38 Favored Pre-proline 0 CA--C 1.547 0.854 0 CA-C-N 121.041 1.746 . . . . 0.0 107.062 177.867 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . 0.644 ' HD2' HG22 ' A' ' 468' ' ' VAL . 19.1 Cg_endo -74.69 174.68 12.25 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.199 2.599 . . . . 0.0 111.076 173.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -74.58 8.73 2.14 Favored 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 124.777 3.651 . . . . 0.0 114.215 174.187 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' LEU . . . . . 0.875 HD12 HD21 ' A' ' 482' ' ' LEU . 2.2 mm? 63.69 55.22 1.72 Allowed 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 129.367 3.067 . . . . 0.0 111.919 178.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -92.22 -39.71 11.39 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.699 0.8 . . . . 0.0 112.383 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -84.22 6.9 20.92 Favored 'General case' 0 N--CA 1.469 0.517 0 O-C-N 120.687 -1.258 . . . . 0.0 113.851 -179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' LEU . . . . . 0.698 HD21 ' CE1' ' A' ' 543' ' ' PHE . 1.5 mp -128.66 -71.41 0.64 Allowed 'General case' 0 C--O 1.207 -1.133 0 C-N-CA 125.569 1.547 . . . . 0.0 109.622 -175.784 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' ASP . . . . . . . . . . . . . 6.5 t70 60.71 162.61 0.06 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-O 122.909 1.338 . . . . 0.0 112.311 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -74.81 -14.63 60.71 Favored 'General case' 0 C--N 1.327 -0.406 0 O-C-N 120.569 -1.332 . . . . 0.0 111.107 178.24 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -63.28 -42.39 99.09 Favored 'General case' 0 N--CA 1.449 -0.519 0 C-N-CA 124.766 1.226 . . . . 0.0 109.752 174.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.53 -49.4 22.15 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 118.941 -1.104 . . . . 0.0 108.328 -176.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' LEU . . . . . 1.007 HD23 HD13 ' A' ' 482' ' ' LEU . 0.1 OUTLIER -117.2 118.12 36.11 Favored Pre-proline 0 N--CA 1.452 -0.358 0 CA-C-O 118.586 -0.721 . . . . 0.0 109.56 -173.778 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_endo -72.3 -2.08 11.14 Favored 'Trans proline' 0 N--CA 1.456 -0.706 0 C-N-CA 122.266 1.978 . . . . 0.0 112.614 -177.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' GLY . . . . . . . . . . . . . . . -107.0 -7.55 33.01 Favored Glycine 0 CA--C 1.53 0.973 0 C-N-CA 124.831 1.205 . . . . 0.0 110.621 173.939 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' LEU . . . . . 1.007 HD13 HD23 ' A' ' 479' ' ' LEU . 2.9 tp -63.12 -32.69 74.13 Favored 'General case' 0 CA--C 1.495 -1.136 0 CA-C-O 116.441 -1.742 . . . . 0.0 108.742 177.883 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' GLY . . . . . . . . . . . . . . . -52.4 -48.13 55.16 Favored Glycine 0 C--O 1.222 -0.631 0 O-C-N 124.392 1.058 . . . . 0.0 110.775 -179.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.8 -44.32 97.0 Favored 'General case' 0 N--CA 1.465 0.277 0 O-C-N 121.547 -0.972 . . . . 0.0 111.928 -179.006 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' PHE . . . . . 0.435 ' CE1' ' HB3' ' A' ' 454' ' ' LEU . 32.8 t80 -66.19 -42.53 88.72 Favored 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 123.271 0.628 . . . . 0.0 110.984 177.558 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -64.64 -48.21 75.67 Favored 'General case' 0 N--CA 1.44 -0.952 0 CA-C-O 116.679 -1.629 . . . . 0.0 107.254 -176.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -62.25 -44.2 97.08 Favored 'General case' 0 C--O 1.226 -0.154 0 C-N-CA 125.497 1.519 . . . . 0.0 109.886 178.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.508 HD11 HD21 ' A' ' 516' ' ' LEU . 5.4 mt -55.47 -53.43 56.38 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.258 0.623 . . . . 0.0 111.005 176.696 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' VAL . . . . . 0.608 HG11 HG11 ' A' ' 468' ' ' VAL . 48.4 t -60.59 -46.78 95.07 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 CA-C-O 116.214 -1.851 . . . . 0.0 110.361 174.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -57.03 -45.9 82.78 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 121.938 2.154 . . . . 0.0 110.361 -174.667 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' THR . . . . . . . . . . . . . 15.8 m -62.34 -47.44 84.19 Favored 'General case' 0 N--CA 1.427 -1.611 0 C-N-CA 126.469 1.908 . . . . 0.0 109.2 173.415 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' CYS . . . . . 0.539 ' SG ' HD11 ' A' ' 458' ' ' LEU . 90.7 m -60.28 -38.58 84.03 Favored 'General case' 0 CA--C 1.555 1.152 0 CA-C-N 119.182 0.901 . . . . 0.0 111.854 177.425 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' LEU . . . . . 0.411 ' CD2' ' HB1' ' A' ' 465' ' ' ALA . 0.7 OUTLIER -60.33 -21.26 61.83 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 129.058 2.943 . . . . 0.0 111.517 175.192 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' SER . . . . . . . . . . . . . 23.5 t -89.45 -64.82 1.09 Allowed 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 105.696 -1.964 . . . . 0.0 105.696 173.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' GLN . . . . . 0.524 HE22 ' CD2' ' A' ' 506' ' ' HIS . 0.3 OUTLIER -57.2 98.4 0.15 Allowed Pre-proline 0 CA--C 1.541 0.612 0 C-N-CA 125.437 1.495 . . . . 0.0 114.124 -173.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -70.48 127.85 14.58 Favored 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.155 1.903 . . . . 0.0 109.963 -174.447 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' GLY . . . . . . . . . . . . . . . 59.77 42.89 98.23 Favored Glycine 0 CA--C 1.528 0.85 0 N-CA-C 110.685 -0.966 . . . . 0.0 110.685 179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' LEU . . . . . 0.583 HD23 ' CB ' ' A' ' 462' ' ' PRO . 10.9 tp -56.26 159.53 3.47 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-O 122.398 1.094 . . . . 0.0 109.009 174.85 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' THR . . . . . 0.43 ' H ' ' HB3' ' A' ' 502' ' ' GLN . 0.2 OUTLIER -125.4 163.48 22.52 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 177.772 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 31.3 m -53.02 -44.5 67.37 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 124.781 1.232 . . . . 0.0 109.514 174.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' GLY . . . . . . . . . . . . . . . -73.58 -41.91 42.08 Favored Glycine 0 N--CA 1.442 -0.911 0 N-CA-C 109.652 -1.379 . . . . 0.0 109.652 -179.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.43 ' HB3' ' H ' ' A' ' 499' ' ' THR . 4.1 tp-100 -58.93 -31.38 68.62 Favored 'General case' 0 CA--C 1.52 -0.186 0 C-N-CA 124.626 1.17 . . . . 0.0 111.849 -176.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 35.4 tp -64.64 -57.35 9.29 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 174.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' LEU . . . . . 0.55 HD21 ' HA ' ' A' ' 517' ' ' GLU . 7.9 mp -59.36 -33.17 70.85 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 118.236 0.471 . . . . 0.0 112.062 179.479 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -68.04 -48.46 65.57 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 124.497 1.119 . . . . 0.0 109.805 177.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' HIS . . . . . 0.524 ' CD2' HE22 ' A' ' 495' ' ' GLN . 68.5 t60 -63.29 -16.48 60.43 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 123.734 0.813 . . . . 0.0 112.417 176.957 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -111.94 16.18 20.43 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.269 1.827 . . . . 0.0 108.969 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' ARG . . . . . . . . . . . . . 7.0 tpt180 -54.86 124.51 16.83 Favored 'General case' 0 C--O 1.227 -0.109 0 O-C-N 120.287 -1.508 . . . . 0.0 108.749 -177.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' GLY . . . . . . . . . . . . . . . 71.77 37.48 61.26 Favored Glycine 0 CA--C 1.529 0.952 0 CA-C-O 119.821 -0.433 . . . . 0.0 112.03 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' THR . . . . . 0.826 HG22 ' H ' ' A' ' 512' ' ' ASN . 28.9 m -108.61 152.78 24.32 Favored 'General case' 0 C--O 1.233 0.203 0 C-N-CA 124.781 1.232 . . . . 0.0 108.737 178.164 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' ASN . . . . . . . . . . . . . 70.3 m-80 -59.75 -25.58 64.98 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 124.369 1.068 . . . . 0.0 110.591 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' ASN . . . . . 0.826 ' H ' HG22 ' A' ' 510' ' ' THR . 9.7 m120 -92.31 -17.47 24.69 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-O 116.02 -1.943 . . . . 0.0 110.181 178.712 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.99 59.3 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 120.016 1.28 . . . . 0.0 109.476 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' ALA . . . . . . . . . . . . . . . -57.25 -45.71 83.72 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 118.891 0.769 . . . . 0.0 112.701 -179.171 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' THR . . . . . . . . . . . . . 31.1 m -66.93 -44.05 81.67 Favored 'General case' 0 CA--C 1.533 0.289 0 O-C-N 121.709 -0.62 . . . . 0.0 109.696 177.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' LEU . . . . . 0.508 HD21 HD11 ' A' ' 488' ' ' LEU . 61.8 mt -59.76 -40.15 87.21 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 125.539 1.536 . . . . 0.0 111.607 177.494 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.55 ' HA ' HD21 ' A' ' 504' ' ' LEU . 1.3 tt0 -68.49 -42.76 78.19 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 127.019 2.128 . . . . 0.0 109.216 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' LYS . . . . . . . . . . . . . 20.8 tttm -61.43 -36.4 80.26 Favored 'General case' 0 CA--C 1.536 0.428 0 O-C-N 121.525 -0.734 . . . . 0.0 109.625 174.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' LEU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 522' ' ' TRP . 32.0 mt -82.37 -8.87 59.63 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 123.978 0.911 . . . . 0.0 112.246 176.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 10.9 t -77.5 -56.66 4.35 Favored 'General case' 0 C--O 1.224 -0.278 0 C-N-CA 124.956 1.303 . . . . 0.0 108.14 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.8 12.85 1.18 Allowed 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.947 1.299 . . . . 0.0 113.274 175.707 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' TRP . . . . . 0.421 ' HB2' ' HA ' ' A' ' 519' ' ' LEU . 2.9 t90 -68.53 128.44 36.63 Favored 'General case' 0 CA--C 1.529 0.165 0 O-C-N 121.189 -0.944 . . . . 0.0 110.903 -175.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -116.66 14.89 15.48 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 127.711 2.405 . . . . 0.0 110.043 -173.372 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -65.99 -29.5 69.89 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 120.237 -1.54 . . . . 0.0 109.853 174.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' ILE . . . . . 0.96 HG21 HD21 ' A' ' 457' ' ' LEU . 0.0 OUTLIER -107.63 -48.85 8.0 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.309 0 C-N-CA 128.441 2.696 . . . . 0.0 110.363 -179.744 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . 41.81 34.28 0.41 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 127.253 2.221 . . . . 0.0 112.576 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -157.93 165.68 34.56 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.821 1.649 . . . . 0.0 108.155 -173.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.8 ttpt -114.56 -35.58 4.85 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.508 1.523 . . . . 0.0 109.365 174.387 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -65.25 -50.76 64.57 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 123.596 0.758 . . . . 0.0 110.051 175.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' ILE . . . . . . . . . . . . . 2.3 mm -62.91 -28.5 45.14 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 N-CA-C 108.349 -0.982 . . . . 0.0 108.349 176.989 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.615 ' CB ' HD22 ' A' ' 457' ' ' LEU . . . -57.44 -61.83 2.21 Favored 'General case' 0 C--O 1.213 -0.837 0 CA-C-N 119.962 1.255 . . . . 0.0 109.111 175.098 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -54.46 -42.55 70.76 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 119.865 1.211 . . . . 0.0 110.612 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' GLN . . . . . . . . . . . . . 1.8 tt0 -61.05 -55.03 37.44 Favored 'General case' 0 CA--C 1.515 -0.4 0 C-N-CA 122.691 0.397 . . . . 0.0 110.842 -179.144 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' THR . . . . . 0.508 HG22 HG21 ' A' ' 453' ' ' ILE . 47.8 m -63.47 -31.71 72.94 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-O 117.414 -1.279 . . . . 0.0 109.102 178.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' PHE . . . . . 0.595 ' CD2' HD13 ' A' ' 464' ' ' LEU . 34.8 t80 -63.16 -54.71 33.45 Favored 'General case' 0 N--CA 1.448 -0.568 0 CA-C-N 121.09 1.768 . . . . 0.0 107.676 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' THR . . . . . . . . . . . . . 90.8 m -59.84 -48.28 82.32 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 123.525 0.73 . . . . 0.0 109.551 178.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' ASP . . . . . . . . . . . . . 15.8 t0 -58.22 -46.23 86.26 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.992 1.717 . . . . 0.0 111.666 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' SER . . . . . . . . . . . . . 13.2 t -69.12 -45.42 70.2 Favored 'General case' 0 C--O 1.246 0.871 0 C-N-CA 126.824 2.05 . . . . 0.0 111.723 178.336 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 2.5 tt -59.76 -47.26 86.37 Favored 'General case' 0 C--N 1.299 -1.603 0 CA-C-N 120.098 1.317 . . . . 0.0 110.753 173.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -59.07 -40.06 84.02 Favored 'General case' 0 C--O 1.207 -1.177 0 O-C-N 120.772 -1.205 . . . . 0.0 113.085 173.776 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' HIS . . . . . . . . . . . . . 5.7 t60 -64.36 -44.29 91.91 Favored 'General case' 0 C--N 1.358 0.952 0 O-C-N 121.161 -0.962 . . . . 0.0 109.451 174.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.45 -52.9 63.67 Favored 'General case' 0 C--O 1.219 -0.533 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 179.506 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' PHE . . . . . 0.698 ' CE1' HD21 ' A' ' 474' ' ' LEU . 2.9 m-85 -62.29 -40.59 96.78 Favored 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 124.304 1.041 . . . . 0.0 109.523 -175.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' ASP . . . . . . . . . . . . . 46.2 t0 -62.21 -53.81 49.95 Favored 'General case' 0 N--CA 1.469 0.519 0 N-CA-C 107.061 -1.459 . . . . 0.0 107.061 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' SER . . . . . . . . . . . . . 3.7 t -51.0 -46.33 61.43 Favored 'General case' 0 N--CA 1.443 -0.806 0 C-N-CA 125.404 1.482 . . . . 0.0 110.817 174.322 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.753 HD21 HD11 ' A' ' 479' ' ' LEU . 80.0 mt -69.01 -39.93 79.0 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-N 119.399 0.999 . . . . 0.0 111.121 -177.423 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.416 ' HB3' HD11 ' A' ' 578' ' ' LEU . 20.2 mt -66.31 -37.29 85.04 Favored 'General case' 0 N--CA 1.448 -0.567 0 CA-C-O 116.997 -1.478 . . . . 0.0 110.255 174.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -65.29 -56.32 13.35 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 126.789 2.036 . . . . 0.0 107.818 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' LEU . . . . . . . . . . . . . 15.6 mt -59.34 -47.1 86.67 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 125.66 1.584 . . . . 0.0 108.244 -178.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.96 -47.13 72.54 Favored 'General case' 0 C--O 1.248 1.004 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' GLN . . . . . 0.461 ' HG3' HD12 ' A' ' 571' ' ' LEU . 27.8 tt0 -50.84 -55.75 15.48 Favored 'General case' 0 CA--C 1.485 -1.542 0 CA-C-O 114.097 -2.859 . . . . 0.0 107.798 175.066 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -59.08 -44.31 91.87 Favored 'General case' 0 C--N 1.316 -0.867 0 O-C-N 125.811 1.944 . . . . 0.0 110.21 -174.231 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -65.13 -48.31 74.05 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 124.71 1.204 . . . . 0.0 109.61 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' LEU . . . . . 1.003 HD11 HD21 ' A' ' 571' ' ' LEU 0.252 0.2 OUTLIER -66.06 -44.33 84.83 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 120.818 -1.176 . . . . 0.0 109.207 176.236 . . . . . . . . 4 4 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' ILE . . . . . . . . . . . . . 1.3 mm -64.25 -38.58 82.89 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.743 0 CA-C-N 120.567 1.531 . . . . 0.0 108.334 -177.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' ALA . . . . . . . . . . . . . . . -54.28 -38.73 66.2 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 126.657 1.983 . . . . 0.0 107.624 174.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.04 -2.15 1.85 Allowed 'General case' 0 C--O 1.221 -0.395 0 CA-C-O 116.659 -1.639 . . . . 0.0 112.582 175.092 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' GLU . . . . . 0.55 ' HB2' HD12 ' A' ' 563' ' ' LEU . 0.5 OUTLIER -82.92 -27.24 30.76 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-N 120.625 1.557 . . . . 0.0 111.338 173.091 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' ARG . . . . . . . . . . . . . 5.5 ttt180 -107.44 -30.28 8.76 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.642 1.11 . . . . 0.0 111.27 -177.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' THR . . . . . . . . . . . . . 65.8 p -77.22 -51.6 10.66 Favored 'General case' 0 CA--C 1.532 0.27 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 -177.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' HIS . . . . . . . . . . . . . 1.1 m-70 -114.3 -36.66 4.6 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 125.224 1.41 . . . . 0.0 111.829 -176.619 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' GLY . . . . . . . . . . . . . . . 102.96 128.4 6.36 Favored Glycine 0 C--N 1.339 0.727 0 C-N-CA 125.574 1.559 . . . . 0.0 110.124 -173.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' LEU . . . . . 0.55 HD12 ' HB2' ' A' ' 558' ' ' GLU . 5.0 mt -87.4 153.23 21.6 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 106.632 -1.618 . . . . 0.0 106.632 173.402 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -67.75 168.52 11.24 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 120.391 -0.524 . . . . 0.0 111.282 178.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' ASN . . . . . . . . . . . . . 1.3 m-20 -58.14 -41.45 83.74 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 177.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' GLU . . . . . . . . . . . . . 28.4 mt-10 -76.08 -53.61 8.08 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 123.276 0.63 . . . . 0.0 109.786 -178.006 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' GLU . . . . . 0.465 ' HB3' HD22 ' A' ' 563' ' ' LEU . 8.5 mt-10 -60.78 -36.07 78.06 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.152 -0.451 . . . . 0.0 110.907 -177.542 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' ARG . . . . . . . . . . . . . 50.6 ttt180 -59.56 -39.08 82.87 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 120.094 1.315 . . . . 0.0 108.678 178.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' LEU . . . . . . . . . . . . . 1.5 mp -74.94 -38.24 61.8 Favored 'General case' 0 C--N 1.342 0.241 0 CA-C-O 117.531 -1.223 . . . . 0.0 111.99 177.19 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 15.3 tp10 -47.52 -40.8 19.57 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 120.244 1.384 . . . . 0.0 107.875 175.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' LEU . . . . . 1.003 HD21 HD11 ' A' ' 554' ' ' LEU . 4.5 mm? -72.12 -34.93 68.96 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-O 115.971 -1.966 . . . . 0.0 110.978 -178.319 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -55.87 -48.29 75.82 Favored 'General case' 0 N--CA 1.442 -0.834 0 CA-C-N 121.109 1.777 . . . . 0.0 107.886 173.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.98 -26.27 68.22 Favored 'General case' 0 C--O 1.216 -0.703 0 C-N-CA 124.15 0.98 . . . . 0.0 111.044 -178.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.508 HD23 HD12 ' A' ' 578' ' ' LEU . 8.0 tt -81.72 -34.08 30.76 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.556 1.542 . . . . 0.0 109.865 176.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 18.5 m-80 -63.67 -44.78 92.73 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.82 1.648 . . . . 0.0 109.317 178.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.29 -30.09 68.1 Favored 'General case' 0 CA--C 1.53 0.2 0 C-N-CA 120.907 -0.317 . . . . 0.0 110.589 177.014 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.72 -35.2 67.5 Favored 'General case' 0 C--O 1.221 -0.443 0 CA-C-O 117.254 -1.355 . . . . 0.0 109.429 -174.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.508 HD12 HD23 ' A' ' 574' ' ' LEU . 13.9 mt -81.54 -22.31 37.96 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 125.39 1.476 . . . . 0.0 112.891 173.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' ALA . . . . . . . . . . . . . . . 50.83 81.14 0.07 Allowed 'General case' 0 CA--C 1.539 0.527 0 C-N-CA 128.996 2.918 . . . . 0.0 115.494 -179.497 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -78.03 108.43 11.3 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.909 178.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' LYS . . . . . . . . . . . . . 5.3 tptt . . . . . 0 N--CA 1.478 0.973 0 C-N-CA 130.62 3.568 . . . . 0.0 111.593 173.463 . . . . . . . . 0 0 . 1 stop_ save_