data_1y8f_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 1y8f _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 ' 568' ' ' ASN . . . . . . . . . . . . . 4.6 t30 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 121.044 0.449 . . . . 0.0 110.132 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.413 ' CZ ' HG13 ' A' ' 602' ' ' VAL . 32.7 m-85 -61.45 117.58 5.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.399 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.57 155.89 25.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.15 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.33 105.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.931 0.396 . . . . 0.0 111.148 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -121.64 132.44 54.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.317 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.4 m -97.23 120.63 37.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.486 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -65.36 109.31 2.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.136 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 24.5 p -72.0 -25.6 61.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.443 . . . . 0.0 110.073 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 22.6 p -136.42 159.68 69.72 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.87 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.28 110.5 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.555 2.17 . . . . 0.0 112.08 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 72.1 m -127.45 137.34 52.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.052 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . 0.435 ' CE1' ' HB2' ' A' ' 586' ' ' LEU . 3.2 m-85 -89.49 156.22 18.78 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.126 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -84.41 126.01 32.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.982 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.423 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.95 -13.31 56.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.136 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -57.62 2.87 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.827 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.2 p -114.87 13.52 17.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 580' ' ' CYS . 12.5 mm-40 47.96 51.26 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.7 123.52 5.26 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.027 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.436 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 16.0 tp -46.29 134.34 8.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.816 0.341 . . . . 0.0 111.23 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.414 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.7 mp -95.04 40.74 1.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.941 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.781 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 CA-C-O 120.683 0.277 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 13.4 tt0 -42.46 158.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.663 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.44 -166.97 31.02 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.561 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 62.3 mmm -127.38 143.61 51.19 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 5.8 ttt180 -146.62 141.13 26.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.979 0.419 . . . . 0.0 111.476 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.0 t -76.85 143.1 39.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.276 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.1 p -98.38 30.75 3.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.941 0.401 . . . . 0.0 110.765 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -139.51 -39.44 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.31 -18.89 12.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.241 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.58 -5.06 85.06 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.614 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.423 HG23 ' CD2' ' A' ' 581' ' ' TYR . 10.3 p -54.44 144.25 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.635 0.218 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.456 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.34 141.34 51.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.861 0.363 . . . . 0.0 110.981 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.7 p -148.55 178.08 8.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.414 ' CD2' HD22 ' A' ' 587' ' ' LEU . 41.1 m80 -75.59 177.13 7.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.264 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.62 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.51 -36.31 14.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.932 0.396 . . . . 0.0 111.384 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 18.0 m -61.55 -19.9 62.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.359 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.13 -34.07 65.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.0 -33.77 18.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 6.4 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.062 179.892 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 121.169 0.509 . . . . 0.0 109.944 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.478 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 27.4 m-85 -61.39 117.58 5.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.639 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.74 150.83 39.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.099 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.52 105.39 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.974 0.416 . . . . 0.0 111.148 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.3 OUTLIER -122.44 126.81 48.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.225 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.1 m -91.38 118.09 30.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.995 0.426 . . . . 0.0 110.823 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.486 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.9 109.45 1.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.7 p -70.19 -28.74 65.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.128 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.1 p -132.94 162.52 57.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.971 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -48.21 110.48 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.508 2.139 . . . . 0.0 111.998 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 53.1 m -126.33 134.19 51.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.05 156.07 21.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.121 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.49 ' O ' ' N ' ' A' ' 584' ' ' GLU . 45.2 t -86.84 123.1 31.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.843 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -15.52 47.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.29 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -85.54 -57.6 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.2 p -114.67 14.23 17.53 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.49 ' N ' ' O ' ' A' ' 580' ' ' CYS . 3.6 mt-10 47.22 51.74 12.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.122 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.4 123.04 4.99 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.051 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.429 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.4 tp -46.22 134.15 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 0.0 111.242 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.418 HD22 ' CD2' ' A' ' 605' ' ' HIS . 1.7 mp -94.01 39.51 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.6 ptt180 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.713 0.292 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.523 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 7.1 tt0 -42.75 152.4 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.682 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.16 -172.71 32.94 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.572 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.478 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.08 145.98 47.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.556 0.217 . . . . 0.0 110.427 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.407 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 6.9 ttt180 -146.68 141.49 26.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.401 . . . . 0.0 111.223 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.0 t -77.71 144.12 37.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.505 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.4 p -99.18 31.3 3.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.935 0.398 . . . . 0.0 110.688 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -140.37 -40.77 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.217 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.5 m -110.44 -18.81 13.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.127 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.99 -5.22 85.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.573 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 15.0 p -54.57 143.93 6.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.648 0.261 . . . . 0.0 111.029 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.461 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -126.18 140.31 52.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.726 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -148.59 178.09 8.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.1 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.418 ' CD2' HD22 ' A' ' 587' ' ' LEU . 47.3 m80 -74.89 -176.89 3.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -72.61 -36.08 68.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.786 0.327 . . . . 0.0 111.315 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -90.68 -46.24 8.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 56.3 m -58.12 -24.79 60.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.356 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.92 -30.61 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 110.53 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -86.61 -31.29 21.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.304 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 11.0 mt . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.004 179.864 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 47.7 t30 . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 121.196 0.522 . . . . 0.0 109.924 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.451 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.4 m-85 -61.12 121.86 13.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.466 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -121.4 153.74 37.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.153 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.39 105.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.956 0.408 . . . . 0.0 111.201 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.482 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -122.05 130.47 53.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.185 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 18.4 m -94.77 120.62 35.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.889 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.482 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.29 109.35 1.86 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.013 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 55.4 p -68.9 -26.21 64.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.09 0.472 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.1 p -140.37 161.74 53.39 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.873 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -44.05 110.78 0.22 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.414 2.076 . . . . 0.0 112.426 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 93.8 m -127.71 134.34 49.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -84.4 156.09 21.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.079 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.561 ' O ' ' N ' ' A' ' 584' ' ' GLU . 41.7 t -90.33 118.07 29.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.783 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -20.36 22.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.368 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -78.11 -57.69 3.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.165 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.9 p -117.71 16.28 14.46 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 580' ' ' CYS . 56.2 mt-10 46.26 52.07 10.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.753 0.311 . . . . 0.0 111.128 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.12 123.03 4.87 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.013 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.418 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 14.9 tp -46.3 133.24 9.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.783 0.325 . . . . 0.0 111.245 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.416 HD23 ' CD2' ' A' ' 605' ' ' HIS . 2.5 mp -93.73 41.94 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.79 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.708 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.3 ptt180 . . . . . 0 CA--C 1.53 0.184 0 CA-C-O 120.651 0.262 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 44.4 tt0 -41.41 156.15 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.716 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -170.0 -171.07 35.14 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.594 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.43 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.3 mmm -123.4 144.52 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.407 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 14.4 ttt180 -146.78 141.05 26.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.416 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 48.1 t -79.04 141.09 37.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.168 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.0 p -96.84 29.73 2.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.384 . . . . 0.0 110.775 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.42 -41.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.903 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.3 m -113.42 -21.04 11.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.096 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.67 3.96 76.75 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.653 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.465 HG11 ' O ' ' A' ' 602' ' ' VAL . 7.3 p -60.83 119.4 4.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.468 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -104.85 138.76 40.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.835 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.1 p -148.66 177.94 9.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.941 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.416 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.9 m80 -74.14 -177.45 2.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.273 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -33.07 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.704 0.288 . . . . 0.0 111.229 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -90.69 -33.53 15.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 53.0 m -68.66 -25.4 64.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.424 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -27.87 62.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.85 0.357 . . . . 0.0 110.684 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.26 -32.31 15.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.534 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.0 mt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.061 179.963 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.0 t30 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 121.097 0.475 . . . . 0.0 109.938 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.459 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.4 m-85 -61.48 113.76 2.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -114.55 152.07 32.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.023 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.6 t -62.4 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 111.253 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.519 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.23 131.19 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.242 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -96.92 117.33 30.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.519 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.56 112.17 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.076 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 61.8 p -72.78 -29.22 63.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.054 0.455 . . . . 0.0 110.077 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.3 p -130.1 162.16 55.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.024 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -49.19 110.44 0.36 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.46 2.107 . . . . 0.0 112.093 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 88.7 m -126.17 140.71 52.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -92.02 156.09 17.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.258 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 584' ' ' GLU . 46.4 t -84.21 122.98 29.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.804 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.422 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -62.17 -15.08 43.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.234 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.54 -57.58 2.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -114.7 14.05 17.46 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 580' ' ' CYS . 41.7 mt-10 47.53 51.57 13.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.033 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.32 122.1 4.81 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.949 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.434 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.5 tp -46.31 133.78 9.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.81 0.338 . . . . 0.0 111.43 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.448 ' CD2' ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.38 41.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.878 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.674 0.273 . . . . 0.0 111.133 . . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.3 tt0 -43.56 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.666 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -168.51 -169.75 32.33 Favored Glycine 0 C--N 1.33 0.201 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.603 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.459 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 68.1 mmm -124.32 144.25 50.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.42 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 13.2 ttt180 -146.7 141.43 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.986 0.422 . . . . 0.0 111.274 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 49.2 t -76.96 143.81 39.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.318 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 31.31 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.403 . . . . 0.0 110.646 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -140.05 -40.39 0.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.8 m -110.23 -19.45 13.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.025 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.65 -5.76 84.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.703 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.422 HG23 ' CG ' ' A' ' 581' ' ' TYR . 13.5 p -54.45 145.82 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.613 0.244 . . . . 0.0 111.087 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.465 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -127.72 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 110.739 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.58 178.08 8.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.448 ' CD2' ' CD2' ' A' ' 587' ' ' LEU . 38.6 m80 -76.94 177.94 7.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.421 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.58 -38.02 89.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.735 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -41.49 11.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.083 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 58.8 m -56.99 -20.97 26.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.508 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -54.65 -35.64 63.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -87.84 -33.77 18.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.47 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 10.6 mt . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.984 179.821 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 121.114 0.483 . . . . 0.0 109.946 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.451 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 25.7 m-85 -61.52 117.3 5.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.715 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.77 154.02 31.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.997 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.35 105.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.015 0.436 . . . . 0.0 111.382 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.518 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.24 129.41 52.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.361 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.7 m -96.09 117.5 30.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.381 . . . . 0.0 110.615 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.518 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.62 111.77 2.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.234 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 23.4 p -71.85 -24.14 61.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.119 0.485 . . . . 0.0 110.162 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 4.0 p -134.99 161.16 65.34 Favored Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.016 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.33 111.15 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.614 2.209 . . . . 0.0 112.103 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 44.2 m -128.68 133.75 48.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . 0.431 ' CE1' ' HB2' ' A' ' 586' ' ' LEU . 3.4 m-85 -85.22 156.16 21.1 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.255 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 584' ' ' GLU . 47.8 t -85.4 122.36 29.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -16.6 42.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.387 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.38 -57.71 3.04 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.4 p -113.18 13.71 19.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.2 mm-40 47.19 51.43 13.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 111.134 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.48 125.72 5.69 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.524 -0.845 . . . . 0.0 112.969 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 579' ' ' TYR . 16.3 tp -46.25 134.68 8.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.112 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.422 HD23 ' CD2' ' A' ' 605' ' ' HIS . 2.1 mp -94.55 38.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.949 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.172 0 CA-C-O 120.748 0.309 . . . . 0.0 111.238 . . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.8 tt0 -45.89 149.99 0.6 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.387 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -161.29 -169.88 25.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.6 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 66.7 mmm -123.08 145.45 48.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -146.74 141.69 27.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.857 0.36 . . . . 0.0 111.107 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.5 t -78.08 143.46 37.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.409 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.2 p -98.92 31.41 2.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.601 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.95 -41.36 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.47 -22.7 10.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.999 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 89.37 7.57 69.42 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.646 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.443 ' O ' HG13 ' A' ' 602' ' ' VAL . 7.6 p -65.05 122.38 15.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.843 0.354 . . . . 0.0 110.841 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.9 OUTLIER -105.87 139.71 40.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.935 0.398 . . . . 0.0 110.877 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.2 p -148.46 177.96 9.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.422 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.6 m80 -74.69 175.91 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.204 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -37.84 88.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.414 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -90.64 -37.96 13.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.897 0.38 . . . . 0.0 111.264 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.04 -19.65 53.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.449 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -54.74 -32.83 60.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.901 0.381 . . . . 0.0 110.639 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.66 -33.9 14.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.515 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 11.9 mt . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.049 179.823 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.178 0.513 . . . . 0.0 109.904 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.497 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 21.9 m-85 -65.76 123.91 21.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.605 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.52 149.76 46.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.167 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.5 105.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 111.31 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.518 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.85 134.91 54.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.251 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 3.4 m -96.03 121.38 37.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 110.93 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.518 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -67.72 109.44 3.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 45.4 p -70.1 -26.69 64.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.118 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 19.5 p -137.08 160.49 65.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.068 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -45.33 110.9 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.327 2.018 . . . . 0.0 112.35 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 99.8 m -126.4 129.92 49.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.08 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -83.66 156.02 22.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.172 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.5 t -84.21 125.17 31.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.54 -12.37 43.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -89.37 -57.57 2.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.6 p -114.75 14.28 17.44 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.6 mm-40 47.74 51.46 14.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.846 0.355 . . . . 0.0 110.965 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.03 120.54 4.5 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.974 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.434 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.7 tp -46.3 134.41 8.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 111.315 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.62 39.75 1.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.763 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.801 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.4 ptp180 . . . . . 0 CA--C 1.529 0.148 0 CA-C-O 120.703 0.287 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.509 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 17.3 tt0 -43.04 156.66 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.75 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -169.32 -170.37 33.79 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.465 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.497 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.91 146.26 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -146.7 140.78 26.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.063 0.459 . . . . 0.0 111.105 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 54.0 t -76.47 144.61 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.585 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 10.4 p -98.65 30.35 3.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.0 110.88 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -141.29 -40.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.035 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.7 m -112.39 -18.78 12.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 82.96 8.97 85.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.569 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 602' ' ' VAL . 7.8 p -65.73 119.47 10.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.461 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.4 mttp -101.67 138.54 38.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.936 0.398 . . . . 0.0 111.001 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.71 178.07 8.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.026 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -76.35 178.15 6.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.231 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.48 -52.09 64.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.594 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -82.46 -39.27 22.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.995 0.426 . . . . 0.0 111.223 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 90.6 m -56.76 -21.41 28.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.329 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -53.86 -41.5 67.56 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.26 -34.5 36.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.474 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 33.7 mt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.965 179.879 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 2.6 t30 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 121.097 0.475 . . . . 0.0 110.196 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -61.3 119.49 8.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.418 -179.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -118.93 155.22 31.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.233 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.37 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.409 . . . . 0.0 111.139 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.494 ' CH2' ' HB3' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.43 123.19 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.249 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 22.3 m -89.71 116.96 28.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.827 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.494 ' HB3' ' CH2' ' A' ' 572' ' ' TRP . . . -59.3 109.43 0.87 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -25.13 64.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.174 0.511 . . . . 0.0 110.058 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.3 p -138.42 160.63 62.93 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.737 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -46.72 110.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.517 2.145 . . . . 0.0 112.128 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 96.9 m -127.66 134.34 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -83.33 156.14 23.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.008 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -88.13 118.56 27.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.763 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.446 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -57.38 -19.94 26.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.324 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -79.51 -57.79 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -116.65 16.8 15.41 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 580' ' ' CYS . 42.2 mt-10 45.75 51.75 10.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 0.0 111.221 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.64 124.47 5.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.89 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.431 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.5 tp -46.33 133.83 9.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.853 0.358 . . . . 0.0 111.238 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 605' ' ' HIS . 0.5 OUTLIER -94.03 39.22 1.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.479 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.816 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.479 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.3 ptt180 . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.77 0.319 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.6 tt0 -37.83 156.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.19 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.49 -175.95 40.2 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.446 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.2 mmm -122.31 144.6 48.9 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 10.4 ttt180 -146.61 141.52 27.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.891 0.377 . . . . 0.0 111.498 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 46.3 t -77.27 144.38 38.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.347 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 13.5 p -99.01 31.03 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.954 0.407 . . . . 0.0 110.799 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.12 -40.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.253 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.0 m -111.17 -15.12 13.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.285 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 84.42 -4.08 84.87 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.699 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.446 HG23 ' CG ' ' A' ' 581' ' ' TYR . 9.2 p -54.58 142.45 8.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.675 0.274 . . . . 0.0 111.011 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.48 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.6 mttp -127.41 139.49 52.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.797 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.5 p -148.71 177.94 9.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.15 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.403 ' CD2' HD22 ' A' ' 587' ' ' LEU . 47.5 m80 -74.1 176.74 6.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.53 78.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.458 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -90.69 -43.54 10.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.043 0.449 . . . . 0.0 111.263 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 52.7 m -55.75 -22.13 22.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.657 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -55.74 -34.79 65.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.673 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -87.59 -32.36 19.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.476 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 20.2 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.979 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.4 t30 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 121.101 0.477 . . . . 0.0 109.919 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.477 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 19.4 m-85 -64.87 120.34 12.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.666 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -120.9 151.11 40.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.049 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.42 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.969 0.414 . . . . 0.0 111.238 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.514 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.22 130.69 53.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.347 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -96.68 117.47 31.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 110.835 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.514 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -65.31 112.37 3.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.8 p -72.25 -24.72 61.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.97 0.414 . . . . 0.0 110.256 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 21.9 p -136.39 160.19 67.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.155 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -45.5 111.64 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.481 2.121 . . . . 0.0 112.564 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 49.2 m -128.32 132.41 48.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -83.5 156.1 23.02 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.238 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.7 t -86.11 124.73 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.782 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.425 ' CG ' HG21 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -63.35 -13.87 43.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.267 179.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -88.14 -57.63 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.1 p -113.91 13.47 18.33 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 24.3 mt-10 47.78 46.48 18.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.856 0.36 . . . . 0.0 111.068 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -119.33 121.97 5.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.996 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.403 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 14.6 tp -46.23 135.81 7.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.816 0.341 . . . . 0.0 111.346 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.423 HD23 ' CD2' ' A' ' 605' ' ' HIS . 2.7 mp -94.02 38.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.482 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.365 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.482 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.728 0.299 . . . . 0.0 111.504 . . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.5 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 8.8 tt0 -49.57 139.68 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.116 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -150.4 -167.77 14.74 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.675 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.477 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 74.8 mmm -120.14 146.18 46.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.603 0.239 . . . . 0.0 110.427 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.433 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.7 ttt180 -146.57 140.57 26.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.018 0.437 . . . . 0.0 111.358 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 54.1 t -78.86 140.5 38.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p -96.8 29.24 3.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.883 0.373 . . . . 0.0 110.845 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -136.73 -40.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.051 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.4 m -110.64 -12.46 14.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.17 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 78.49 5.73 87.97 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.469 -0.872 . . . . 0.0 112.739 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 11.7 p -65.87 145.81 13.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.577 0.227 . . . . 0.0 110.981 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.3 mttm -127.18 139.13 53.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.949 0.404 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.58 177.94 9.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.205 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.423 ' CD2' HD23 ' A' ' 587' ' ' LEU . 44.8 m80 -73.6 175.31 7.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.243 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.98 -37.36 87.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.672 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.43 -32.79 16.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 5.4 m -65.13 -19.35 65.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.472 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -53.5 -32.61 51.06 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.951 0.405 . . . . 0.0 110.65 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -93.61 -37.18 12.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.516 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 12.7 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.095 179.973 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 19.7 t30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.107 0.48 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.433 ' CE1' HG11 ' A' ' 602' ' ' VAL . 31.5 m-85 -61.44 124.24 20.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.368 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -122.9 154.63 38.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.235 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 28.3 t -62.41 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.011 0.434 . . . . 0.0 110.925 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.528 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.6 OUTLIER -124.34 131.62 53.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.458 179.854 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.455 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 32.2 m -99.55 116.78 32.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.002 0.43 . . . . 0.0 110.678 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.528 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.32 119.05 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.205 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 19.6 p -76.04 -26.27 56.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 0.0 110.072 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 p -135.4 160.47 67.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.93 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -45.51 111.61 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.321 2.014 . . . . 0.0 112.512 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 53.7 m -129.31 128.36 43.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -78.41 156.06 29.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.538 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.8 t -88.56 119.98 29.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.43 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -58.37 -18.73 29.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.332 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -80.81 -57.75 3.41 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.7 p -115.83 15.89 16.31 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 580' ' ' CYS . 43.8 mt-10 46.06 48.0 12.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 111.232 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.89 124.64 5.83 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.995 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.412 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.0 tp -46.26 133.35 9.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.362 . . . . 0.0 111.249 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 2.2 mp -93.34 39.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.858 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.469 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.961 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.469 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 6.8 ptt180 . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.689 0.281 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.455 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 22.1 tt0 -44.98 154.29 0.15 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.465 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.02 -165.41 24.37 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.758 -0.735 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.427 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.7 mmm -127.43 143.82 51.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.404 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 10.8 ttt180 -146.54 140.49 26.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.028 0.442 . . . . 0.0 111.44 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.7 t -77.12 141.59 40.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.352 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 73.2 p -97.75 30.56 2.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.98 0.419 . . . . 0.0 110.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -138.33 -40.03 0.52 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.097 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.5 m -113.15 -21.13 11.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.064 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.11 0.01 78.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.625 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.433 HG11 ' CE1' ' A' ' 569' ' ' PHE . 7.1 p -58.57 126.6 16.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.966 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.6 OUTLIER -112.09 139.37 47.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.59 177.84 9.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.006 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -73.64 174.03 8.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.254 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.09 -36.93 85.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.542 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.54 -38.7 13.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 111.368 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.53 -20.1 53.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.55 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -55.95 -39.52 71.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.949 0.404 . . . . 0.0 110.683 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -82.51 -34.72 27.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.491 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.973 179.931 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.4 t30 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 121.179 0.514 . . . . 0.0 110.059 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.476 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 21.6 m-85 -64.7 122.18 16.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.628 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.54 150.93 41.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.322 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.4 105.53 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.971 0.415 . . . . 0.0 111.251 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.494 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.37 132.4 53.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.272 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -94.79 121.79 36.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.005 0.431 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.494 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.23 109.42 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 33.6 p -69.11 -27.9 65.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.06 0.457 . . . . 0.0 109.933 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.8 p -135.98 162.14 58.47 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.851 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -47.65 110.47 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.44 2.094 . . . . 0.0 112.043 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 97.7 m -124.91 131.26 53.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -81.29 156.11 25.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.029 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -86.86 122.76 31.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.794 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -61.98 -14.6 36.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.372 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -87.99 -57.68 2.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.912 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.6 p -113.22 14.15 19.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.8 mm-40 46.81 48.57 14.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 0.0 111.22 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.45 123.55 5.53 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.967 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.433 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.3 tp -46.24 134.39 8.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.866 0.365 . . . . 0.0 111.397 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.426 HD21 ' CD2' ' A' ' 605' ' ' HIS . 1.2 mp -93.66 40.0 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.468 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.846 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.468 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt-85 . . . . . 0 CA--C 1.529 0.165 0 CA-C-O 120.677 0.275 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.514 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 9.7 tt0 -42.41 153.6 0.07 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.711 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.42 -170.21 31.96 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.527 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.5 mmm -123.07 143.7 49.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.408 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 3.8 ttt-85 -144.76 140.96 28.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.019 0.438 . . . . 0.0 111.167 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 52.8 t -76.06 144.34 40.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.482 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.9 p -98.82 30.79 3.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -140.78 -40.69 0.41 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.027 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.63 -20.14 11.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.166 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.27 4.39 83.82 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.626 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 602' ' ' VAL . 7.4 p -61.47 120.88 8.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.825 0.345 . . . . 0.0 110.837 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -105.35 138.47 41.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 111.065 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.72 177.83 9.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.806 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.426 ' CD2' HD21 ' A' ' 587' ' ' LEU . 47.2 m80 -73.56 -176.85 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.111 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.88 -37.04 67.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.655 0.264 . . . . 0.0 111.366 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -32.53 16.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.891 0.377 . . . . 0.0 111.262 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 54.3 m -71.19 -24.79 62.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.339 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -28.01 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.96 -34.54 13.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.558 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 7.9 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.007 179.851 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 30.1 t30 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.028 0.442 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.417 ' CZ ' HG12 ' A' ' 602' ' ' VAL . 38.3 m-85 -61.35 113.44 2.64 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.195 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -114.21 156.86 23.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.151 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.43 105.29 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.974 0.416 . . . . 0.0 110.938 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.564 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -121.99 133.9 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.378 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.2 m -98.72 117.52 33.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.683 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.564 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -67.15 114.02 5.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.176 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 56.1 p -72.97 -25.33 60.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.01 0.433 . . . . 0.0 110.169 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 23.7 p -134.18 159.85 70.76 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.144 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . 0.401 ' CA ' HD12 ' A' ' 586' ' ' LEU . 89.1 Cg_exo -46.35 112.38 0.46 Allowed 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.439 2.093 . . . . 0.0 112.44 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 42.9 m -128.35 134.18 48.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.822 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 586' ' ' LEU . 3.2 m-85 -86.11 156.22 20.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.311 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.479 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.9 t -84.99 123.56 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.121 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.426 ' CD2' HG22 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -61.19 -15.39 33.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.365 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -88.08 -57.67 2.85 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.0 p -112.45 13.33 20.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 580' ' ' CYS . 76.1 mm-40 47.1 50.06 14.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.772 0.32 . . . . 0.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.78 124.38 5.66 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.034 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.435 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 17.1 tp -46.3 135.02 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.329 . . . . 0.0 111.292 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.421 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.4 mp -94.67 39.12 1.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.496 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.77 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.496 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.642 0.258 . . . . 0.0 111.19 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.492 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.4 OUTLIER -40.63 159.98 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.892 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -173.1 -170.0 36.23 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.589 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 68.4 mmm -122.15 143.91 49.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt180 -146.73 142.01 27.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.913 0.387 . . . . 0.0 111.504 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 46.4 t -78.28 142.59 37.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.166 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.6 p -98.16 30.5 3.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.916 0.388 . . . . 0.0 110.785 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -138.32 -40.26 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.217 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.8 m -111.54 -20.25 12.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.74 -4.19 81.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.615 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 13.7 p -54.5 145.15 4.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.608 0.242 . . . . 0.0 110.922 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.477 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.7 141.89 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.927 0.394 . . . . 0.0 110.767 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.36 178.07 8.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.046 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.421 ' CD2' HD22 ' A' ' 587' ' ' LEU . 43.7 m80 -76.82 178.7 6.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.27 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -66.84 -36.64 82.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.645 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -34.61 15.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.408 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.9 m -64.38 -21.82 66.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.502 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -56.3 -37.24 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 110.655 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -35.54 27.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.458 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 36.5 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 179.889 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.3 t30 . . . . . 0 C--O 1.233 0.195 0 CA-C-O 121.084 0.469 . . . . 0.0 110.028 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.401 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 38.6 m-85 -61.29 115.95 4.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.392 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.67 154.76 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.108 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.36 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.938 0.399 . . . . 0.0 111.265 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 1.2 t90 -122.64 129.2 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.408 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 19.7 m -97.87 116.95 31.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.688 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.42 119.13 9.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.165 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 29.0 p -77.15 -26.88 53.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.106 0.479 . . . . 0.0 110.118 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 17.6 p -134.44 160.8 67.09 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.944 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -45.36 111.09 0.29 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.399 2.066 . . . . 0.0 112.402 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 56.2 m -129.83 125.01 34.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.977 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -75.28 156.04 36.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.251 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' A' ' 584' ' ' GLU . 52.3 t -86.65 120.26 27.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.807 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CD2' HG21 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -57.96 -18.65 24.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.357 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -83.12 -57.74 3.15 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.08 15.04 18.4 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mp0 46.32 47.77 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 111.26 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.33 125.24 6.09 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.859 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . . . . . . . . . 15.6 tp -46.21 133.6 9.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.872 0.368 . . . . 0.0 111.266 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.422 HD22 ' CD2' ' A' ' 605' ' ' HIS . 0.9 OUTLIER -94.06 38.62 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.925 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.5 ptp180 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.711 0.291 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.451 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.2 tt0 -45.23 154.02 0.18 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.389 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.48 -170.37 31.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.693 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.401 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 59.7 mmm -124.38 144.69 49.89 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.43 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 8.5 ttt180 -146.62 142.0 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.924 0.393 . . . . 0.0 111.201 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.3 t -76.43 142.99 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.388 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -98.83 31.39 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.965 0.412 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -139.75 -39.72 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.114 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.1 m -111.14 -20.79 12.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.179 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 91.01 -5.12 81.85 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.596 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 11.6 p -54.42 142.44 8.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.602 0.239 . . . . 0.0 111.04 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.464 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.2 OUTLIER -127.02 140.45 52.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -148.61 177.9 9.09 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.422 ' CD2' HD22 ' A' ' 587' ' ' LEU . 50.4 m80 -72.82 176.03 5.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.269 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -64.38 -35.63 81.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.496 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -43.25 10.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.425 . . . . 0.0 111.222 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.1 m -55.27 -22.32 17.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.623 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -54.01 -39.46 66.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.925 0.393 . . . . 0.0 110.74 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -32.51 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.439 179.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 7.7 mt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.016 179.95 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.053 0.454 . . . . 0.0 110.103 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.407 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 24.9 m-85 -66.23 122.73 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.484 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -122.19 155.42 35.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.211 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.4 105.33 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.957 0.408 . . . . 0.0 111.17 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.51 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.93 129.29 51.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.295 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.482 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.7 m -96.06 117.14 30.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 0.0 110.693 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.51 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.12 110.66 2.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.056 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.1 p -69.5 -24.21 63.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.199 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 23.2 p -137.36 160.01 67.2 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.039 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -46.18 111.9 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.401 2.067 . . . . 0.0 112.473 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 73.3 m -129.6 135.85 49.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.917 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -85.02 156.11 21.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.404 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.51 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.5 t -86.8 122.01 30.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -16.51 35.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.427 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -83.98 -57.6 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 20.4 p -115.44 14.94 16.79 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 580' ' ' CYS . 6.1 mt-10 46.46 51.8 11.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.331 . . . . 0.0 111.165 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.55 123.83 5.22 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.956 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.416 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.5 tp -46.29 133.79 9.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 111.253 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 2.2 mp -93.98 39.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.001 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.466 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.466 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt85 . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.732 0.301 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.482 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 4.4 tt0 -45.0 155.63 0.11 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.425 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.31 -167.88 26.6 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.626 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.407 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.4 mmm -126.24 143.24 51.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 7.3 ttt180 -146.69 141.43 26.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.383 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.8 t -77.15 143.16 39.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 28.5 p -98.46 30.61 3.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.877 0.37 . . . . 0.0 110.724 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -139.14 -40.37 0.47 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.121 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.7 m -110.37 -17.67 13.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.67 -5.0 85.77 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.67 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.425 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 12.4 p -54.5 142.86 7.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 O-C-N 122.734 -0.274 . . . . 0.0 111.023 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.7 mttp -126.53 140.44 52.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.857 0.361 . . . . 0.0 110.801 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.56 177.97 9.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.05 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -75.31 176.82 7.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.08 -41.85 94.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.514 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -38.76 13.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.035 0.445 . . . . 0.0 111.142 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 88.4 m -59.03 -20.52 53.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.12 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.02 -42.0 75.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.994 0.426 . . . . 0.0 110.385 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.6 -33.93 58.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.138 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 56.4 mt . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.978 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.8 t30 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 121.092 0.472 . . . . 0.0 110.126 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . . . . . . . . . 36.7 m-85 -61.35 114.88 3.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.323 -179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -113.7 153.7 28.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.077 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.3 105.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 111.071 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.494 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.42 130.81 53.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.272 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.495 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -93.39 119.61 32.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.412 . . . . 0.0 110.913 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.494 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.31 109.49 1.92 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.261 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.2 p -72.12 -27.86 62.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.022 0.439 . . . . 0.0 109.982 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.7 p -133.4 162.23 58.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.911 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -47.5 110.45 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.413 2.075 . . . . 0.0 112.053 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 93.7 m -125.68 130.97 52.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.192 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.25 156.12 22.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.925 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.4 t -85.44 123.13 30.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.912 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.418 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -62.96 -14.09 42.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -88.99 -57.66 2.82 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.37 13.16 20.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 13.5 mt-10 47.42 51.35 13.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.27 122.81 4.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.951 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.428 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.4 tp -46.25 134.36 8.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 111.288 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.409 HD21 ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.12 38.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.81 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.669 0.271 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.495 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 1.1 tt0 -43.14 154.48 0.07 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.682 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.76 -163.71 22.15 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.689 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.6 mmm -129.44 144.56 51.3 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.426 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 22.5 ttt-85 -146.65 140.48 26.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.974 0.416 . . . . 0.0 111.308 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.5 t -75.67 142.77 42.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.397 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.4 p -98.49 30.97 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.654 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -139.37 -40.01 0.47 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.239 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.16 -20.58 12.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.56 -5.18 82.51 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.684 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 12.0 p -54.36 145.67 4.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 CA-C-N 116.744 0.272 . . . . 0.0 110.954 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.73 141.13 51.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.895 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.6 p -148.42 178.06 8.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.125 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.409 ' CD2' HD21 ' A' ' 587' ' ' LEU . 40.8 m80 -74.97 175.76 7.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.354 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -63.63 -37.7 88.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.593 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -90.47 -40.3 12.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.952 0.406 . . . . 0.0 111.184 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 13.4 m -58.24 -19.87 37.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.398 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -54.97 -33.69 62.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.965 0.412 . . . . 0.0 110.606 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -90.44 -33.8 15.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.38 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.7 mt . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.04 179.978 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.0 t30 . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 121.113 0.482 . . . . 0.0 110.187 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -66.47 115.77 6.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.292 -179.423 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -114.23 155.09 26.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.113 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 33.4 t -62.37 105.21 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.952 0.406 . . . . 0.0 111.044 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.493 ' CH2' ' HB1' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.14 132.59 54.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.18 119.24 34.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.943 0.401 . . . . 0.0 110.857 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.493 ' HB1' ' CH2' ' A' ' 572' ' ' TRP . . . -66.08 109.48 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.094 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 1.9 p -70.78 -30.25 66.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.114 0.483 . . . . 0.0 110.017 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -131.64 162.98 52.93 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.952 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.1 110.54 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.465 2.11 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 52.9 m -125.48 134.29 52.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.148 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -85.08 156.06 21.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.852 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.53 ' O ' ' N ' ' A' ' 584' ' ' GLU . 51.4 t -87.9 120.53 29.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.991 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.412 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -58.87 -18.08 29.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.351 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -83.02 -57.7 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.1 p -114.98 14.28 17.14 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.4 mt-10 46.97 51.45 12.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.58 123.49 5.11 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.938 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.412 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.1 tp -46.26 131.59 10.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.85 0.357 . . . . 0.0 111.207 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 1.9 mp -93.48 42.72 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.448 ' CZ3' ' HB2' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 588' ' ' TRP . 3.0 ptt180 . . . . . 0 CA--C 1.529 0.167 0 CA-C-O 120.778 0.323 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.1 tt0 -45.02 152.6 0.23 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.695 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.71 -158.92 10.68 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.423 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 63.9 mmm -131.32 144.66 51.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.0 ttt-85 -146.51 140.7 26.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.961 0.41 . . . . 0.0 111.316 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.8 t -76.72 142.22 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 29.8 p -97.85 30.52 2.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.954 0.406 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -137.72 -40.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.013 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -111.86 -16.94 13.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.133 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.8 -3.91 86.66 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.689 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 11.4 p -54.58 145.36 4.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.555 0.217 . . . . 0.0 111.01 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.456 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.57 140.51 51.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.94 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.8 p -148.59 178.0 9.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -75.04 174.9 8.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.394 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -63.52 -38.17 90.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.608 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -34.49 15.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.922 0.391 . . . . 0.0 111.328 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 7.9 m -62.67 -19.2 63.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.251 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -54.8 -34.14 62.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.982 0.42 . . . . 0.0 110.633 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.07 -35.69 15.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.396 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 7.5 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.85 179.766 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.034 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.454 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 26.0 m-85 -62.13 121.77 13.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.583 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.64 152.87 37.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.167 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.37 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.976 0.417 . . . . 0.0 111.25 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.11 130.01 52.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.299 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.1 m -91.98 119.97 32.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.857 0.36 . . . . 0.0 110.844 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.37 109.35 1.57 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.127 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 11.5 p -70.45 -26.05 63.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.118 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 13.9 p -139.4 161.05 59.28 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.81 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -44.35 111.14 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.339 2.026 . . . . 0.0 112.418 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 87.5 m -125.72 135.33 51.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -88.41 156.03 19.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.159 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.3 t -85.26 126.06 33.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.85 -11.41 46.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -91.53 -57.65 2.69 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.47 10.12 19.68 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mm-40 50.13 50.36 18.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.52 120.64 4.37 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.971 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.408 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 14.4 tp -46.26 131.58 10.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.874 0.369 . . . . 0.0 111.415 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.456 ' CD2' ' CD2' ' A' ' 605' ' ' HIS . 2.4 mp -93.03 44.8 1.16 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.591 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.832 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.669 0.271 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 10.2 tt0 -41.23 153.36 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.808 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.65 -171.53 33.74 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.551 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.454 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 64.4 mmm -122.05 144.72 48.74 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt-85 -146.45 140.02 25.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 111.277 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.23 142.34 41.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.454 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.9 p -97.18 29.96 2.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.944 0.402 . . . . 0.0 110.699 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -137.98 -42.01 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.024 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.4 m -111.74 -18.4 12.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.135 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.19 -2.83 86.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.431 HG13 ' CE1' ' A' ' 569' ' ' PHE . 9.6 p -55.78 132.59 19.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 110.958 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.7 OUTLIER -115.71 140.38 49.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.989 0.423 . . . . 0.0 110.936 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.62 178.12 8.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.088 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.456 ' CD2' ' CD2' ' A' ' 587' ' ' LEU . 36.6 m80 -75.63 176.57 7.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.32 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.21 -37.66 88.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.626 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.48 -41.52 11.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.951 0.405 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 13.2 m -56.96 -21.01 26.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.386 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -53.21 -35.98 60.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.832 0.349 . . . . 0.0 110.796 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.47 -35.42 15.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.552 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 6.7 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.899 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 121.102 0.477 . . . . 0.0 110.041 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.472 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 30.8 m-85 -61.42 120.83 11.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.61 150.72 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.31 105.39 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.88 0.371 . . . . 0.0 111.049 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.528 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.52 129.34 51.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.48 179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.5 m -95.83 117.38 30.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.907 0.384 . . . . 0.0 110.606 179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.528 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.48 111.07 2.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.244 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 22.3 p -69.8 -24.09 63.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.001 0.429 . . . . 0.0 110.238 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 34.9 p -136.87 159.43 70.19 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.151 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -46.02 112.11 0.41 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.48 2.12 . . . . 0.0 112.433 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 52.0 m -129.2 135.45 48.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -84.75 156.04 21.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.229 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.0 t -86.73 121.4 29.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.413 ' CG ' HG21 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -59.98 -17.07 35.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.234 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.85 -57.74 2.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.8 p -112.99 13.38 19.48 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.2 mt-10 46.77 49.62 14.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 111.169 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.19 124.73 5.57 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.938 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.424 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.3 tp -46.2 134.47 8.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.298 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.6 mp -94.11 39.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.696 0.284 . . . . 0.0 111.137 . . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.476 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.1 OUTLIER -45.22 153.38 0.21 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 -179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.14 -172.54 31.74 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.472 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 71.9 mmm -121.18 144.58 48.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.65 0.262 . . . . 0.0 110.314 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.413 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.1 ttt180 -146.68 141.21 26.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 111.197 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 52.6 t -76.83 144.31 39.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.478 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.6 p -98.96 30.85 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.955 0.407 . . . . 0.0 110.756 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -140.89 -40.37 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.178 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.49 -18.44 13.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.08 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.71 -5.67 84.35 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.632 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.413 HG21 ' CG ' ' A' ' 581' ' ' TYR . 14.4 p -54.69 142.63 8.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.61 0.243 . . . . 0.0 111.073 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.474 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.1 mttm -125.68 140.79 52.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.799 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -148.71 177.92 9.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.416 ' CD2' HD22 ' A' ' 587' ' ' LEU . 49.4 m80 -75.37 174.38 9.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.217 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -32.91 74.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -90.7 -43.85 9.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.046 0.451 . . . . 0.0 111.076 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.9 m -60.34 -24.77 65.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.429 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -28.4 62.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.352 . . . . 0.0 110.675 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -91.08 -31.35 16.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.448 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 3.4 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.103 -179.947 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 5.0 t30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.074 0.464 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.415 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 31.1 m-85 -61.48 124.53 20.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.492 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -124.12 154.01 40.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.208 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 27.9 t -62.4 105.46 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.948 0.404 . . . . 0.0 111.149 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.511 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.2 OUTLIER -122.95 134.34 54.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.313 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.5 121.18 38.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.381 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.511 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.3 109.41 2.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.131 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 5.3 p -71.05 -25.83 62.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.092 0.472 . . . . 0.0 109.995 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.5 p -136.42 161.09 64.11 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.782 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -47.71 110.48 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.504 2.136 . . . . 0.0 112.05 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 94.8 m -124.77 136.8 54.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.182 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -86.8 156.14 20.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.523 ' O ' ' N ' ' A' ' 584' ' ' GLU . 53.2 t -89.44 119.65 30.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.416 ' CG ' HG21 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -59.36 -18.2 36.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.388 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.32 -57.86 3.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 31.8 p -113.48 13.57 18.89 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.1 OUTLIER 46.9 51.57 12.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.808 0.337 . . . . 0.0 111.092 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.98 123.13 4.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.952 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.426 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.1 tp -46.14 133.81 8.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.319 . . . . 0.0 111.445 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.409 HD21 ' CD2' ' A' ' 605' ' ' HIS . 2.8 mp -94.27 43.03 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.662 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.471 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.863 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.471 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 2.8 ptt85 . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.673 0.273 . . . . 0.0 111.222 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.49 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 16.8 tt0 -41.35 155.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.779 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.31 -170.14 35.06 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.584 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.415 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.9 mmm -122.28 145.99 47.71 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.429 -0.211 . . . . 0.0 110.429 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -146.53 141.87 27.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 111.386 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 48.6 t -79.12 140.41 37.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.201 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 69.7 p -97.27 30.92 2.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.005 0.431 . . . . 0.0 110.54 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -136.95 -40.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.22 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.1 m -112.37 -22.24 10.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.272 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 94.08 -5.47 72.0 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.734 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.416 HG21 ' CG ' ' A' ' 581' ' ' TYR . 11.4 p -54.5 144.55 5.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.685 0.278 . . . . 0.0 110.958 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.484 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.9 mttp -127.65 140.13 52.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.899 0.381 . . . . 0.0 110.727 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.47 177.97 9.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.023 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.409 ' CD2' HD21 ' A' ' 587' ' ' LEU . 45.2 m80 -75.06 -177.06 3.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.233 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.46 -35.66 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.464 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -34.73 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 27.6 m -67.57 -23.8 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.372 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -28.51 66.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.886 0.374 . . . . 0.0 110.622 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -88.79 -33.43 17.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.328 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.088 179.902 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 11.6 t30 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 121.127 0.489 . . . . 0.0 110.094 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.454 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.8 m-85 -61.99 116.76 5.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.5 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -116.96 151.39 36.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.279 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 30.1 t -62.49 105.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 111.087 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.516 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -124.44 130.21 52.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.365 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -94.52 119.04 32.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.764 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.516 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -62.93 110.42 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.117 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 9.7 p -71.94 -26.25 62.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.092 0.472 . . . . 0.0 109.965 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 43.3 p -136.03 159.46 70.97 Favored Pre-proline 0 N--CA 1.454 -0.243 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.967 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.38 111.39 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.45 2.1 . . . . 0.0 112.497 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 92.7 m -127.28 138.39 53.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.06 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -89.01 156.09 19.08 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.061 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.496 ' O ' ' N ' ' A' ' 584' ' ' GLU . 43.2 t -88.25 122.33 31.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CG ' HG22 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -61.54 -16.39 47.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.269 179.717 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -84.17 -57.62 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.3 p -116.04 16.03 16.09 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.9 mp0 45.84 52.21 9.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 111.247 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.36 122.86 4.76 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.071 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.433 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 16.4 tp -46.35 135.92 7.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.267 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.418 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.5 mp -95.43 39.88 1.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.779 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.757 0.313 . . . . 0.0 111.191 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.2 tt0 -42.99 153.82 0.08 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.592 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.96 -168.67 29.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.796 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.454 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.7 mmm -125.79 144.1 50.78 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.401 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 9.5 ttt180 -146.66 141.09 26.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.036 0.446 . . . . 0.0 111.57 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 42.5 t -79.0 144.24 34.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.228 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.8 p -99.61 32.15 2.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 0.0 110.569 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -139.25 -41.2 0.46 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.155 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.68 -17.36 13.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.49 -6.02 83.22 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.657 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.417 HG22 ' CG ' ' A' ' 581' ' ' TYR . 14.3 p -54.53 142.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.757 0.313 . . . . 0.0 111.068 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -126.12 141.45 51.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.666 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.1 p -148.32 178.05 8.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.418 ' CD2' HD22 ' A' ' 587' ' ' LEU . 47.2 m80 -76.65 177.36 7.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.184 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.1 -59.32 5.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.576 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -36.48 64.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 0.0 111.597 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.8 m -57.77 -21.46 41.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.48 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -55.32 -35.43 65.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.9 0.381 . . . . 0.0 110.801 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 -35.46 18.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.72 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.057 179.88 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.9 t30 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 121.178 0.513 . . . . 0.0 109.915 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 569' ' ' PHE . . . . . 0.441 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 23.1 m-85 -61.48 125.74 24.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.675 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -128.39 153.81 46.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.219 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.38 105.41 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 0.0 111.147 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 572' ' ' TRP . . . . . 0.537 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -123.6 132.93 53.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.374 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 573' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.2 m -99.75 117.36 33.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.648 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 574' ' ' ALA . . . . . 0.537 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -65.82 118.25 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.319 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.5 p -77.06 -26.51 53.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.168 0.509 . . . . 0.0 110.053 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 64.1 p -131.95 157.93 76.88 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.912 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -45.85 111.37 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.666 2.244 . . . . 0.0 112.193 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 33.9 m -127.61 131.91 49.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -82.99 156.09 23.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.151 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 580' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -85.68 122.12 29.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 581' ' ' TYR . . . . . 0.425 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.43 -13.96 35.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.395 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.09 -57.64 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.4 4.94 24.93 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 584' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.8 OUTLIER 53.93 48.94 20.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.57 126.09 5.6 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.949 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 586' ' ' LEU . . . . . 0.431 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.0 tp -46.31 134.42 8.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 111.234 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 587' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 605' ' ' HIS . 0.9 OUTLIER -94.53 39.62 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.802 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.1 ptt180 . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.751 0.31 . . . . 0.0 111.306 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 593' ' ' GLN . . . . . 0.447 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 34.4 tt0 -45.62 154.76 0.19 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.397 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.45 -163.62 21.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.699 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 595' ' ' MET . . . . . 0.441 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 69.3 mmm -126.79 144.99 50.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.353 -0.239 . . . . 0.0 110.353 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 596' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 0.2 OUTLIER -145.63 141.78 28.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.974 0.416 . . . . 0.0 111.228 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.5 t -78.92 142.21 36.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.237 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.9 p -98.38 31.32 2.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.992 0.425 . . . . 0.0 110.564 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -139.42 -40.76 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.224 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.0 m -112.41 -21.21 11.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.253 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 92.41 -4.6 76.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.623 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 602' ' ' VAL . . . . . 0.425 HG23 ' CD2' ' A' ' 581' ' ' TYR . 8.0 p -54.41 140.84 11.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.632 0.253 . . . . 0.0 110.876 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 603' ' ' LYS . . . . . 0.453 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -124.88 139.82 53.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.856 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -148.71 177.88 9.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.066 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 605' ' ' HIS . . . . . 0.451 ' CD2' ' CD2' ' A' ' 587' ' ' LEU . 54.3 m80 -75.86 177.73 6.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.283 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -67.48 -35.23 78.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.285 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -90.85 -47.32 7.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 91.0 m -59.44 -22.35 61.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.497 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.09 66.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.866 0.365 . . . . 0.0 110.434 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.28 -30.46 18.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.393 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 13.9 mt . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.133 179.934 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 5.8 tt0 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.815 0.34 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.45 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 94.8 m-70 -65.36 130.74 44.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.96 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -77.68 61.96 2.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.132 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.45 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 32.7 m-85 -61.45 117.58 5.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.399 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -114.57 155.89 25.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.15 179.354 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.33 105.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.931 0.396 . . . . 0.0 111.148 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -121.64 132.44 54.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.317 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.4 m -97.23 120.63 37.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.486 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -65.36 109.31 2.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.136 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 24.5 p -72.0 -25.6 61.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.443 . . . . 0.0 110.073 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 22.6 p -136.42 159.68 69.72 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.87 179.38 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -45.28 110.5 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.555 2.17 . . . . 0.0 112.08 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 72.1 m -127.45 137.34 52.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.052 -179.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . 0.435 ' CE1' ' HB2' ' A' ' 586' ' ' LEU . 3.2 m-85 -89.49 156.22 18.78 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.126 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -84.41 126.01 32.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.982 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.423 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.95 -13.31 56.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.136 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -57.62 2.87 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.827 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.2 p -114.87 13.52 17.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 580' ' ' CYS . 12.5 mm-40 47.96 51.26 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.7 123.52 5.26 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.027 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.436 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 16.0 tp -46.29 134.34 8.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.816 0.341 . . . . 0.0 111.23 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.414 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.7 mp -95.04 40.74 1.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.941 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.44 -165.06 1.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.781 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.41 -76.15 0.22 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.51 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 56.9 mt -131.42 -61.49 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.775 0.321 . . . . 0.0 111.064 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.24 90.39 4.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.222 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER -54.66 -21.31 10.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.17 179.658 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 13.4 tt0 -42.46 158.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.663 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.44 -166.97 31.02 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.561 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 62.3 mmm -127.38 143.61 51.19 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.422 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 5.8 ttt180 -146.62 141.13 26.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.979 0.419 . . . . 0.0 111.476 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.0 t -76.85 143.1 39.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.276 179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.1 p -98.38 30.75 3.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.941 0.401 . . . . 0.0 110.765 -179.922 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -139.51 -39.44 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.31 -18.89 12.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.241 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.58 -5.06 85.06 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.614 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.423 HG23 ' CD2' ' A' ' 581' ' ' TYR . 10.3 p -54.44 144.25 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.635 0.218 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.456 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.34 141.34 51.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.861 0.363 . . . . 0.0 110.981 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.7 p -148.55 178.08 8.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.414 ' CD2' HD22 ' A' ' 587' ' ' LEU . 41.1 m80 -75.59 177.13 7.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.264 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.62 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.51 -36.31 14.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.932 0.396 . . . . 0.0 111.384 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 18.0 m -61.55 -19.9 62.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.359 -179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.13 -34.07 65.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.0 -33.77 18.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 6.4 mt -71.28 -30.85 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.062 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.14 152.06 17.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.048 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -78.23 143.16 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.777 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.418 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -100.27 149.72 23.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -176.48 39.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.836 0.35 . . . . 0.0 111.23 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.429 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 96.2 m-70 -64.68 131.32 46.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.014 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -75.54 64.61 1.66 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.169 0.509 . . . . 0.0 109.944 179.41 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.478 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 27.4 m-85 -61.39 117.58 5.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.639 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.74 150.83 39.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.099 179.398 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.52 105.39 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.974 0.416 . . . . 0.0 111.148 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.486 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.3 OUTLIER -122.44 126.81 48.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.225 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.523 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.1 m -91.38 118.09 30.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.995 0.426 . . . . 0.0 110.823 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.486 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.9 109.45 1.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.7 p -70.19 -28.74 65.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.128 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.1 p -132.94 162.52 57.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.971 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.6 Cg_endo -48.21 110.48 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.508 2.139 . . . . 0.0 111.998 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 53.1 m -126.33 134.19 51.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.05 156.07 21.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.121 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.49 ' O ' ' N ' ' A' ' 584' ' ' GLU . 45.2 t -86.84 123.1 31.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.843 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -15.52 47.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.29 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -85.54 -57.6 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.2 p -114.67 14.23 17.53 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.49 ' N ' ' O ' ' A' ' 580' ' ' CYS . 3.6 mt-10 47.22 51.74 12.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.122 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.4 123.04 4.99 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.051 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.429 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.4 tp -46.22 134.15 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 0.0 111.242 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.418 HD22 ' CD2' ' A' ' 605' ' ' HIS . 1.7 mp -94.01 39.51 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.36 -168.58 1.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 112.72 -79.28 0.26 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.525 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 12.9 mt -127.23 -62.07 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 0.0 111.114 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.05 90.19 4.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.6 ptt180 -53.88 -21.73 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.237 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.523 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 7.1 tt0 -42.75 152.4 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.682 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.16 -172.71 32.94 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.572 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.478 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.08 145.98 47.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.556 0.217 . . . . 0.0 110.427 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.407 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 6.9 ttt180 -146.68 141.49 26.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.401 . . . . 0.0 111.223 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.0 t -77.71 144.12 37.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.505 179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 16.4 p -99.18 31.3 3.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.935 0.398 . . . . 0.0 110.688 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -140.37 -40.77 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.217 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.5 m -110.44 -18.81 13.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.127 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.99 -5.22 85.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.573 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.407 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 15.0 p -54.57 143.93 6.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.648 0.261 . . . . 0.0 111.029 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.461 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -126.18 140.31 52.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.726 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -148.59 178.09 8.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.1 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.418 ' CD2' HD22 ' A' ' 587' ' ' LEU . 47.3 m80 -74.89 -176.89 3.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.285 179.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -72.61 -36.08 68.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.786 0.327 . . . . 0.0 111.315 -179.69 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -90.68 -46.24 8.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 56.3 m -58.12 -24.79 60.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.356 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -57.92 -30.61 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 110.53 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -86.61 -31.29 21.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.304 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 11.0 mt -74.41 -32.11 62.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.28 142.36 32.05 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.998 -179.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.3 157.43 33.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -108.41 141.67 39.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.1 179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -161.06 41.76 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.687 0.28 . . . . 0.0 111.142 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.453 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.0 m-70 -68.72 131.22 44.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -79.31 63.46 3.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.196 0.522 . . . . 0.0 109.924 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.453 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 33.4 m-85 -61.12 121.86 13.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.466 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -121.4 153.74 37.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.153 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.39 105.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.956 0.408 . . . . 0.0 111.201 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.482 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -122.05 130.47 53.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.185 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 18.4 m -94.77 120.62 35.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.889 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.482 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.29 109.35 1.86 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.013 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 55.4 p -68.9 -26.21 64.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.09 0.472 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.1 p -140.37 161.74 53.39 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.873 179.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -44.05 110.78 0.22 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.414 2.076 . . . . 0.0 112.426 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 93.8 m -127.71 134.34 49.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -84.4 156.09 21.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.079 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.561 ' O ' ' N ' ' A' ' 584' ' ' GLU . 41.7 t -90.33 118.07 29.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.783 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -56.83 -20.36 22.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.368 179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -78.11 -57.69 3.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.165 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.9 p -117.71 16.28 14.46 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 580' ' ' CYS . 56.2 mt-10 46.26 52.07 10.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.753 0.311 . . . . 0.0 111.128 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.12 123.03 4.87 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.013 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.418 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 14.9 tp -46.3 133.24 9.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.783 0.325 . . . . 0.0 111.245 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.416 HD23 ' CD2' ' A' ' 605' ' ' HIS . 2.5 mp -93.73 41.94 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.79 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -111.01 -165.91 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.708 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.47 -74.18 0.21 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.509 -179.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 39.8 mm -132.58 -61.18 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.814 0.34 . . . . 0.0 111.127 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.68 90.29 3.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.261 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.3 ptt180 -53.6 -21.56 6.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.116 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 44.4 tt0 -41.41 156.15 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.716 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -170.0 -171.07 35.14 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.594 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.43 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.3 mmm -123.4 144.52 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.407 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 14.4 ttt180 -146.78 141.05 26.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.416 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 48.1 t -79.04 141.09 37.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.168 179.078 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.0 p -96.84 29.73 2.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.384 . . . . 0.0 110.775 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.42 -41.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.903 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.3 m -113.42 -21.04 11.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.096 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.67 3.96 76.75 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.653 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.465 HG11 ' O ' ' A' ' 602' ' ' VAL . 7.3 p -60.83 119.4 4.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.468 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -104.85 138.76 40.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.835 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.1 p -148.66 177.94 9.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.941 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.416 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.9 m80 -74.14 -177.45 2.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.273 179.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.36 -33.07 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.704 0.288 . . . . 0.0 111.229 -179.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -90.69 -33.53 15.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 53.0 m -68.66 -25.4 64.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.424 -179.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.18 -27.87 62.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.85 0.357 . . . . 0.0 110.684 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.26 -32.31 15.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.534 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.0 mt -75.93 -32.81 59.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.061 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.7 136.3 56.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.073 -179.815 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.68 169.0 5.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.43 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -111.95 148.04 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.151 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -161.1 39.67 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.847 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.841 179.983 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.787 0.327 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.452 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.4 m-70 -58.99 134.82 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.899 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -76.64 63.44 2.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.938 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.459 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.4 m-85 -61.48 113.76 2.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -114.55 152.07 32.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.023 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.6 t -62.4 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 111.253 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.519 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.23 131.19 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.242 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -96.92 117.33 30.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.519 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.56 112.17 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.076 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 61.8 p -72.78 -29.22 63.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.054 0.455 . . . . 0.0 110.077 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.3 p -130.1 162.16 55.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.024 179.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_endo -49.19 110.44 0.36 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.46 2.107 . . . . 0.0 112.093 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 88.7 m -126.17 140.71 52.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.889 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -92.02 156.09 17.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.258 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 584' ' ' GLU . 46.4 t -84.21 122.98 29.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.804 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.422 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -62.17 -15.08 43.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.234 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.54 -57.58 2.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -114.7 14.05 17.46 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 580' ' ' CYS . 41.7 mt-10 47.53 51.57 13.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.033 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.32 122.1 4.81 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.949 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.434 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.5 tp -46.31 133.78 9.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.81 0.338 . . . . 0.0 111.43 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.448 ' CD2' ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.38 41.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.82 -166.74 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.878 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.68 -80.95 0.28 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.551 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 6.5 mt -125.07 -61.75 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.736 0.303 . . . . 0.0 111.205 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.4 90.42 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER -54.09 -21.66 9.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.133 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.3 tt0 -43.56 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.666 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -168.51 -169.75 32.33 Favored Glycine 0 C--N 1.33 0.201 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.603 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.459 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 68.1 mmm -124.32 144.25 50.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.42 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 13.2 ttt180 -146.7 141.43 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.986 0.422 . . . . 0.0 111.274 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 49.2 t -76.96 143.81 39.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.318 179.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 31.31 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.403 . . . . 0.0 110.646 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -140.05 -40.39 0.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.8 m -110.23 -19.45 13.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.025 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.65 -5.76 84.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.703 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.422 HG23 ' CG ' ' A' ' 581' ' ' TYR . 13.5 p -54.45 145.82 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.613 0.244 . . . . 0.0 111.087 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.465 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -127.72 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 110.739 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.58 178.08 8.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.448 ' CD2' ' CD2' ' A' ' 587' ' ' LEU . 38.6 m80 -76.94 177.94 7.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.421 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.58 -38.02 89.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.735 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -41.49 11.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.083 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 58.8 m -56.99 -20.97 26.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.508 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -54.65 -35.64 63.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -87.84 -33.77 18.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.47 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 10.6 mt -70.67 -30.57 67.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.984 179.821 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.63 151.93 19.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.109 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 6.9 m-20 -61.25 -168.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.89 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -150.81 143.49 24.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.152 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -167.39 39.47 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.813 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.85 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.812 0.339 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.447 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.4 m-70 -59.06 133.85 56.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.971 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -77.45 61.55 2.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.946 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.451 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 25.7 m-85 -61.52 117.3 5.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.715 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.77 154.02 31.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.997 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.35 105.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.015 0.436 . . . . 0.0 111.382 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.518 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.24 129.41 52.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.361 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.456 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.7 m -96.09 117.5 30.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.381 . . . . 0.0 110.615 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.518 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.62 111.77 2.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.234 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 23.4 p -71.85 -24.14 61.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.119 0.485 . . . . 0.0 110.162 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 4.0 p -134.99 161.16 65.34 Favored Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.016 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.33 111.15 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.614 2.209 . . . . 0.0 112.103 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 44.2 m -128.68 133.75 48.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . 0.431 ' CE1' ' HB2' ' A' ' 586' ' ' LEU . 3.4 m-85 -85.22 156.16 21.1 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.255 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 584' ' ' GLU . 47.8 t -85.4 122.36 29.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -60.82 -16.6 42.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.387 179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.38 -57.71 3.04 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.4 p -113.18 13.71 19.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.2 mm-40 47.19 51.43 13.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 111.134 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.48 125.72 5.69 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.524 -0.845 . . . . 0.0 112.969 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.431 ' HB2' ' CE1' ' A' ' 579' ' ' TYR . 16.3 tp -46.25 134.68 8.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.112 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.422 HD23 ' CD2' ' A' ' 605' ' ' HIS . 2.1 mp -94.55 38.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.44 31.56 5.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.949 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -90.27 81.54 1.38 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.275 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 2.4 mp 68.86 -69.02 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.766 0.317 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -92.21 93.05 8.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.217 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.4 OUTLIER -51.63 -23.05 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.238 179.695 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.456 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.8 tt0 -45.89 149.99 0.6 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.387 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -161.29 -169.88 25.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.6 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 66.7 mmm -123.08 145.45 48.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.7 ttt180 -146.74 141.69 27.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.857 0.36 . . . . 0.0 111.107 -179.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.5 t -78.08 143.46 37.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.409 179.395 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.2 p -98.92 31.41 2.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.601 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.95 -41.36 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.47 -22.7 10.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.999 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 89.37 7.57 69.42 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.646 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.443 ' O ' HG13 ' A' ' 602' ' ' VAL . 7.6 p -65.05 122.38 15.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.843 0.354 . . . . 0.0 110.841 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.9 OUTLIER -105.87 139.71 40.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.935 0.398 . . . . 0.0 110.877 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.2 p -148.46 177.96 9.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.422 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.6 m80 -74.69 175.91 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.204 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -37.84 88.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.414 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -90.64 -37.96 13.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.897 0.38 . . . . 0.0 111.264 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 14.5 m -60.04 -19.65 53.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.449 -179.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -54.74 -32.83 60.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.901 0.381 . . . . 0.0 110.639 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.66 -33.9 14.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.515 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 11.9 mt -70.14 -29.14 65.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.049 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -56.99 152.45 13.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.161 -179.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 14.5 p-10 -80.48 118.29 21.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.75 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -66.76 143.99 56.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.144 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -170.49 59.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.825 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.758 0.313 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.438 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 97.2 m-70 -59.2 135.82 57.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -71.54 65.74 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.178 0.513 . . . . 0.0 109.904 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.497 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 21.9 m-85 -65.76 123.91 21.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.605 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -124.52 149.76 46.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.167 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.5 105.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 111.31 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.518 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.85 134.91 54.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.251 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.509 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 3.4 m -96.03 121.38 37.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 110.93 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.518 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -67.72 109.44 3.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 45.4 p -70.1 -26.69 64.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.118 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 19.5 p -137.08 160.49 65.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.068 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 86.6 Cg_exo -45.33 110.9 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.327 2.018 . . . . 0.0 112.35 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 99.8 m -126.4 129.92 49.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.08 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 29.7 m-85 -83.66 156.02 22.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.172 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.5 t -84.21 125.17 31.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.54 -12.37 43.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.804 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -89.37 -57.57 2.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.6 p -114.75 14.28 17.44 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.6 mm-40 47.74 51.46 14.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.846 0.355 . . . . 0.0 110.965 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.03 120.54 4.5 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.974 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.434 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.7 tp -46.3 134.41 8.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 111.315 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.62 39.75 1.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.763 179.886 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -109.2 -165.69 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.801 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.98 -80.6 0.27 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 47.6 mt -126.0 -61.98 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 0.0 111.099 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.63 90.58 4.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.19 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.4 ptp180 -53.08 -21.84 5.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.183 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.509 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 17.3 tt0 -43.04 156.66 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.75 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -169.32 -170.37 33.79 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.465 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.497 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.91 146.26 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -146.7 140.78 26.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.063 0.459 . . . . 0.0 111.105 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 54.0 t -76.47 144.61 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.585 179.45 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 10.4 p -98.65 30.35 3.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.0 110.88 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -141.29 -40.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.035 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.7 m -112.39 -18.78 12.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 82.96 8.97 85.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.569 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.456 ' O ' HG13 ' A' ' 602' ' ' VAL . 7.8 p -65.73 119.47 10.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.461 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.4 mttp -101.67 138.54 38.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.936 0.398 . . . . 0.0 111.001 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.71 178.07 8.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.026 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -76.35 178.15 6.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.231 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.48 -52.09 64.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.594 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -82.46 -39.27 22.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.995 0.426 . . . . 0.0 111.223 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 90.6 m -56.76 -21.41 28.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.329 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -53.86 -41.5 67.56 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.26 -34.5 36.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.474 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 33.7 mt -69.48 -31.64 70.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.965 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 2.0 tt -59.14 154.64 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.063 -179.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -60.72 -177.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.729 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.438 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -139.99 140.2 36.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.39 39.57 0.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.818 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.865 -179.941 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.772 0.32 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.7 m-70 -59.28 130.61 47.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.982 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -78.33 61.24 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.196 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.449 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 33.5 m-85 -61.3 119.49 8.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.418 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 61.6 mt-10 -118.93 155.22 31.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.233 179.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.37 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.409 . . . . 0.0 111.139 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.494 ' CH2' ' HB3' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.43 123.19 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.249 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.504 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 22.3 m -89.71 116.96 28.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.827 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.494 ' HB3' ' CH2' ' A' ' 572' ' ' TRP . . . -59.3 109.43 0.87 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -25.13 64.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.174 0.511 . . . . 0.0 110.058 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 12.3 p -138.42 160.63 62.93 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.737 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_endo -46.72 110.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.517 2.145 . . . . 0.0 112.128 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 96.9 m -127.66 134.34 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 -179.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -83.33 156.14 23.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.008 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -88.13 118.56 27.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.763 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.446 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -57.38 -19.94 26.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.324 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -79.51 -57.79 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -116.65 16.8 15.41 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 580' ' ' CYS . 42.2 mt-10 45.75 51.75 10.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 0.0 111.221 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.64 124.47 5.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.89 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.431 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.5 tp -46.33 133.83 9.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.853 0.358 . . . . 0.0 111.238 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.403 HD22 ' CD2' ' A' ' 605' ' ' HIS . 0.5 OUTLIER -94.03 39.22 1.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.479 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.86 160.9 15.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.816 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 121.78 81.86 0.62 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.542 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 21.2 mt 69.34 -65.76 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 0.0 111.408 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.7 88.67 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 111.597 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.479 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.3 ptt180 -62.33 -18.09 60.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.034 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.504 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.6 tt0 -37.83 156.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.19 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.49 -175.95 40.2 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.446 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.2 mmm -122.31 144.6 48.9 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.429 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 10.4 ttt180 -146.61 141.52 27.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.891 0.377 . . . . 0.0 111.498 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 46.3 t -77.27 144.38 38.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.347 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 13.5 p -99.01 31.03 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.954 0.407 . . . . 0.0 110.799 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.12 -40.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.253 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.0 m -111.17 -15.12 13.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.285 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 84.42 -4.08 84.87 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.699 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.446 HG23 ' CG ' ' A' ' 581' ' ' TYR . 9.2 p -54.58 142.45 8.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.675 0.274 . . . . 0.0 111.011 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.48 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.6 mttp -127.41 139.49 52.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.797 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.5 p -148.71 177.94 9.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.15 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.403 ' CD2' HD22 ' A' ' 587' ' ' LEU . 47.5 m80 -74.1 176.74 6.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.53 78.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.458 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -90.69 -43.54 10.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.043 0.449 . . . . 0.0 111.263 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 52.7 m -55.75 -22.13 22.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.657 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -55.74 -34.79 65.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.673 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -87.59 -32.36 19.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.476 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 20.2 mt -72.65 -31.82 65.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.66 144.46 43.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.025 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.2 m-20 -66.44 164.09 17.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.751 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -120.55 139.03 53.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.183 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -171.26 39.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.786 0.327 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.426 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.0 m-70 -58.92 135.1 57.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -72.42 63.9 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 109.919 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.477 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 19.4 m-85 -64.87 120.34 12.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.666 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -120.9 151.11 40.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.049 179.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.42 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.969 0.414 . . . . 0.0 111.238 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.514 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.22 130.69 53.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.347 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.5 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -96.68 117.47 31.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 110.835 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.514 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -65.31 112.37 3.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.8 p -72.25 -24.72 61.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.97 0.414 . . . . 0.0 110.256 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 21.9 p -136.39 160.19 67.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.155 179.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -45.5 111.64 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.481 2.121 . . . . 0.0 112.564 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 49.2 m -128.32 132.41 48.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -83.5 156.1 23.02 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.238 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.7 t -86.11 124.73 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.782 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.425 ' CG ' HG21 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -63.35 -13.87 43.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.267 179.864 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -88.14 -57.63 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.1 p -113.91 13.47 18.33 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 24.3 mt-10 47.78 46.48 18.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.856 0.36 . . . . 0.0 111.068 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -119.33 121.97 5.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.996 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.403 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 14.6 tp -46.23 135.81 7.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.816 0.341 . . . . 0.0 111.346 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.423 HD23 ' CD2' ' A' ' 605' ' ' HIS . 2.7 mp -94.02 38.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.482 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -113.55 17.9 17.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.365 -179.629 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -57.49 -65.39 3.59 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.381 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . 0.469 HD11 HG21 ' A' ' 590' ' ' ILE . 62.4 mt -139.98 -60.46 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.825 0.345 . . . . 0.0 110.593 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -97.78 93.06 6.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.697 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.482 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER -43.72 -27.67 0.34 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 179.963 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.5 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 8.8 tt0 -49.57 139.68 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.116 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -150.4 -167.77 14.74 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.675 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.477 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 74.8 mmm -120.14 146.18 46.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.603 0.239 . . . . 0.0 110.427 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.433 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.7 ttt180 -146.57 140.57 26.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.018 0.437 . . . . 0.0 111.358 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 54.1 t -78.86 140.5 38.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 179.149 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 80.3 p -96.8 29.24 3.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.883 0.373 . . . . 0.0 110.845 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -136.73 -40.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.051 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.4 m -110.64 -12.46 14.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.17 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 78.49 5.73 87.97 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.469 -0.872 . . . . 0.0 112.739 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.433 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 11.7 p -65.87 145.81 13.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.577 0.227 . . . . 0.0 110.981 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.3 mttm -127.18 139.13 53.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.949 0.404 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.58 177.94 9.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.205 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.423 ' CD2' HD23 ' A' ' 587' ' ' LEU . 44.8 m80 -73.6 175.31 7.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.243 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.98 -37.36 87.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.672 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.43 -32.79 16.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 5.4 m -65.13 -19.35 65.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.472 -179.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -53.5 -32.61 51.06 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.951 0.405 . . . . 0.0 110.65 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -93.61 -37.18 12.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.516 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 12.7 mt -66.86 -27.88 67.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.095 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -56.58 151.3 13.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.099 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -76.23 111.02 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.892 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -71.43 141.12 50.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.112 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -177.3 39.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.899 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 65.9 tt0 . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.449 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 98.0 m-70 -59.08 134.29 56.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.927 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -77.99 61.43 2.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.107 0.48 . . . . 0.0 110.195 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.449 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 31.5 m-85 -61.44 124.24 20.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.368 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -122.9 154.63 38.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.235 179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 28.3 t -62.41 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.011 0.434 . . . . 0.0 110.925 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.528 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.6 OUTLIER -124.34 131.62 53.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.458 179.854 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.455 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 32.2 m -99.55 116.78 32.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.002 0.43 . . . . 0.0 110.678 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.528 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.32 119.05 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.205 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 19.6 p -76.04 -26.27 56.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 0.0 110.072 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 p -135.4 160.47 67.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.93 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -45.51 111.61 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.321 2.014 . . . . 0.0 112.512 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 53.7 m -129.31 128.36 43.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -78.41 156.06 29.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.538 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.8 t -88.56 119.98 29.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.43 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -58.37 -18.73 29.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.332 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -80.81 -57.75 3.41 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.7 p -115.83 15.89 16.31 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 580' ' ' CYS . 43.8 mt-10 46.06 48.0 12.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 111.232 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.89 124.64 5.83 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.995 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.412 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.0 tp -46.26 133.35 9.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.362 . . . . 0.0 111.249 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 2.2 mp -93.34 39.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.858 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.469 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.88 30.57 6.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.961 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.49 80.37 1.62 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.219 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 5.1 mt 68.98 -68.58 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.715 0.293 . . . . 0.0 111.099 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -91.83 93.29 8.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.902 0.382 . . . . 0.0 111.162 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.469 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 6.8 ptt180 -51.81 -22.84 4.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.321 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.455 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 22.1 tt0 -44.98 154.29 0.15 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.465 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.02 -165.41 24.37 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.758 -0.735 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.427 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.7 mmm -127.43 143.82 51.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.404 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 10.8 ttt180 -146.54 140.49 26.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.028 0.442 . . . . 0.0 111.44 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.7 t -77.12 141.59 40.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.352 179.127 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 73.2 p -97.75 30.56 2.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.98 0.419 . . . . 0.0 110.787 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -138.33 -40.03 0.52 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.097 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.5 m -113.15 -21.13 11.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.064 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.11 0.01 78.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.625 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.433 HG11 ' CE1' ' A' ' 569' ' ' PHE . 7.1 p -58.57 126.6 16.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.966 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.6 OUTLIER -112.09 139.37 47.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.59 177.84 9.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.006 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -73.64 174.03 8.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.254 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.09 -36.93 85.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.542 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.54 -38.7 13.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 111.368 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.53 -20.1 53.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.55 -179.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -55.95 -39.52 71.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.949 0.404 . . . . 0.0 110.683 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -82.51 -34.72 27.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.491 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt -70.49 -30.99 67.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.973 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.88 146.66 41.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.997 -179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -60.86 -171.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.839 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -148.71 146.37 28.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.148 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -170.69 39.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.925 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.825 0.345 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.439 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 98.1 m-70 -59.72 134.52 57.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.4 t30 -73.01 64.61 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.179 0.514 . . . . 0.0 110.059 179.381 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.476 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 21.6 m-85 -64.7 122.18 16.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.628 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -122.54 150.93 41.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.322 179.507 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.4 105.53 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.971 0.415 . . . . 0.0 111.251 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.494 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.37 132.4 53.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.272 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.514 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -94.79 121.79 36.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.005 0.431 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.494 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.23 109.42 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 33.6 p -69.11 -27.9 65.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.06 0.457 . . . . 0.0 109.933 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.8 p -135.98 162.14 58.47 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.851 179.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_endo -47.65 110.47 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.44 2.094 . . . . 0.0 112.043 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 97.7 m -124.91 131.26 53.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 -179.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -81.29 156.11 25.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.029 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -86.86 122.76 31.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.794 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.403 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -61.98 -14.6 36.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.372 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -87.99 -57.68 2.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.912 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.6 p -113.22 14.15 19.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.8 mm-40 46.81 48.57 14.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 0.0 111.22 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.45 123.55 5.53 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.967 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.433 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.3 tp -46.24 134.39 8.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.866 0.365 . . . . 0.0 111.397 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.426 HD21 ' CD2' ' A' ' 605' ' ' HIS . 1.2 mp -93.66 40.0 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.468 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -111.03 -166.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.846 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.91 -72.93 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.584 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 4.4 mp -133.85 -60.5 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.861 0.362 . . . . 0.0 111.179 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -102.88 89.91 3.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.201 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.468 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt-85 -52.84 -22.04 4.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.224 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.514 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 9.7 tt0 -42.41 153.6 0.07 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.711 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.42 -170.21 31.96 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.527 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.5 mmm -123.07 143.7 49.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.408 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 3.8 ttt-85 -144.76 140.96 28.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.019 0.438 . . . . 0.0 111.167 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 52.8 t -76.06 144.34 40.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.482 179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 12.9 p -98.82 30.79 3.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -140.78 -40.69 0.41 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.027 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.63 -20.14 11.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.166 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.27 4.39 83.82 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.626 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.447 ' O ' HG13 ' A' ' 602' ' ' VAL . 7.4 p -61.47 120.88 8.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.825 0.345 . . . . 0.0 110.837 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -105.35 138.47 41.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 111.065 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.72 177.83 9.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.806 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.426 ' CD2' HD21 ' A' ' 587' ' ' LEU . 47.2 m80 -73.56 -176.85 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.111 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.88 -37.04 67.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.655 0.264 . . . . 0.0 111.366 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -32.53 16.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.891 0.377 . . . . 0.0 111.262 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 54.3 m -71.19 -24.79 62.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.339 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -28.01 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.96 -34.54 13.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.558 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 7.9 mt -72.87 -28.14 62.32 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.007 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -54.53 153.72 5.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.189 -179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 10.6 m-80 -78.69 131.41 36.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.937 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.439 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -80.11 142.0 35.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -154.77 38.67 0.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.995 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.845 0.355 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 89.4 m-70 -63.38 120.64 12.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.064 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 30.1 t30 -75.62 63.63 1.58 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.127 179.408 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.455 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 38.3 m-85 -61.35 113.44 2.64 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.195 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -114.21 156.86 23.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.151 179.489 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.43 105.29 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.974 0.416 . . . . 0.0 110.938 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.564 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -121.99 133.9 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.378 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.492 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.2 m -98.72 117.52 33.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.683 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.564 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -67.15 114.02 5.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.176 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 56.1 p -72.97 -25.33 60.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.01 0.433 . . . . 0.0 110.169 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 23.7 p -134.18 159.85 70.76 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.144 179.353 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . 0.401 ' CA ' HD12 ' A' ' 586' ' ' LEU . 89.1 Cg_exo -46.35 112.38 0.46 Allowed 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.439 2.093 . . . . 0.0 112.44 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 42.9 m -128.35 134.18 48.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.822 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 586' ' ' LEU . 3.2 m-85 -86.11 156.22 20.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.311 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.479 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.9 t -84.99 123.56 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.121 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.426 ' CD2' HG22 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -61.19 -15.39 33.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.365 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -88.08 -57.67 2.85 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.0 p -112.45 13.33 20.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 580' ' ' CYS . 76.1 mm-40 47.1 50.06 14.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.772 0.32 . . . . 0.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.78 124.38 5.66 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.034 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.435 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 17.1 tp -46.3 135.02 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.329 . . . . 0.0 111.292 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.421 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.4 mp -94.67 39.12 1.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.496 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.19 142.32 38.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.77 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 139.69 87.52 0.15 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.501 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 11.2 mt 68.31 -69.13 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.723 0.297 . . . . 0.0 111.299 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.17 87.83 3.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.92 0.391 . . . . 0.0 111.334 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.496 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.1 OUTLIER -59.18 -18.9 40.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.19 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.492 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.4 OUTLIER -40.63 159.98 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.892 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -173.1 -170.0 36.23 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.589 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 68.4 mmm -122.15 143.91 49.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt180 -146.73 142.01 27.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.913 0.387 . . . . 0.0 111.504 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 46.4 t -78.28 142.59 37.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.166 179.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 2.6 p -98.16 30.5 3.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.916 0.388 . . . . 0.0 110.785 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -138.32 -40.26 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.217 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.8 m -111.54 -20.25 12.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.74 -4.19 81.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.615 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 13.7 p -54.5 145.15 4.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.608 0.242 . . . . 0.0 110.922 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.477 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.7 141.89 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.927 0.394 . . . . 0.0 110.767 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.36 178.07 8.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.046 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.421 ' CD2' HD22 ' A' ' 587' ' ' LEU . 43.7 m80 -76.82 178.7 6.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.27 179.402 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -66.84 -36.64 82.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.645 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -34.61 15.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.408 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.9 m -64.38 -21.82 66.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.502 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -56.3 -37.24 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 110.655 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -35.54 27.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.458 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 36.5 mt -69.37 -33.17 72.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.5 137.55 58.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.887 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -178.14 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -126.47 140.95 52.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.072 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -165.41 53.94 0.11 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.932 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.848 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.786 0.327 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.47 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 94.2 m-70 -65.88 128.28 35.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.038 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -78.83 63.4 3.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.028 179.439 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.47 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 38.6 m-85 -61.29 115.95 4.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.392 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.67 154.76 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.108 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.36 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.938 0.399 . . . . 0.0 111.265 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 1.2 t90 -122.64 129.2 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.408 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.451 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 19.7 m -97.87 116.95 31.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.688 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.42 119.13 9.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.165 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 29.0 p -77.15 -26.88 53.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.106 0.479 . . . . 0.0 110.118 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 17.6 p -134.44 160.8 67.09 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.944 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -45.36 111.09 0.29 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.399 2.066 . . . . 0.0 112.402 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 56.2 m -129.83 125.01 34.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.977 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -75.28 156.04 36.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.251 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' A' ' 584' ' ' GLU . 52.3 t -86.65 120.26 27.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.807 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CD2' HG21 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -57.96 -18.65 24.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.357 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -83.12 -57.74 3.15 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.08 15.04 18.4 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mp0 46.32 47.77 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 111.26 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.33 125.24 6.09 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.859 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . . . . . . . . . 15.6 tp -46.21 133.6 9.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.872 0.368 . . . . 0.0 111.266 179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.422 HD22 ' CD2' ' A' ' 605' ' ' HIS . 0.9 OUTLIER -94.06 38.62 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.35 29.91 6.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.925 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.75 80.41 1.59 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.259 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 51.8 mt 69.2 -67.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.764 0.316 . . . . 0.0 111.173 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -92.41 92.99 8.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.5 ptp180 -52.77 -22.73 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.225 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.451 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.2 tt0 -45.23 154.02 0.18 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.389 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.48 -170.37 31.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.693 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.401 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 59.7 mmm -124.38 144.69 49.89 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.43 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 8.5 ttt180 -146.62 142.0 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.924 0.393 . . . . 0.0 111.201 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.3 t -76.43 142.99 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.388 179.142 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 18.7 p -98.83 31.39 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.965 0.412 . . . . 0.0 110.684 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -139.75 -39.72 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.114 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.1 m -111.14 -20.79 12.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.179 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 91.01 -5.12 81.85 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.596 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.429 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 11.6 p -54.42 142.44 8.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.602 0.239 . . . . 0.0 111.04 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.464 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.2 OUTLIER -127.02 140.45 52.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -148.61 177.9 9.09 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.422 ' CD2' HD22 ' A' ' 587' ' ' LEU . 50.4 m80 -72.82 176.03 5.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.269 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -64.38 -35.63 81.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.496 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -43.25 10.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.425 . . . . 0.0 111.222 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.1 m -55.27 -22.32 17.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.623 -179.615 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -54.01 -39.46 66.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.925 0.393 . . . . 0.0 110.74 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -32.51 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.439 179.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 7.7 mt -71.04 -30.33 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.016 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.05 133.17 55.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.01 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -72.02 134.49 45.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -67.26 152.22 46.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -176.04 40.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.901 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.948 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 16.1 tt0 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.753 0.311 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.451 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 98.6 m-70 -59.61 137.98 57.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -75.45 62.95 1.41 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.103 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.451 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 24.9 m-85 -66.23 122.73 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.484 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 18.3 mt-10 -122.19 155.42 35.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.211 179.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.4 105.33 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.957 0.408 . . . . 0.0 111.17 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.51 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.93 129.29 51.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.295 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.482 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.7 m -96.06 117.14 30.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 0.0 110.693 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.51 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.12 110.66 2.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.056 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.1 p -69.5 -24.21 63.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.199 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 23.2 p -137.36 160.01 67.2 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.039 179.38 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_exo -46.18 111.9 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.401 2.067 . . . . 0.0 112.473 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 73.3 m -129.6 135.85 49.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.917 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -85.02 156.11 21.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.404 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.51 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.5 t -86.8 122.01 30.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.3 -16.51 35.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.427 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -83.98 -57.6 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 20.4 p -115.44 14.94 16.79 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 580' ' ' CYS . 6.1 mt-10 46.46 51.8 11.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.331 . . . . 0.0 111.165 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.55 123.83 5.22 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.956 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.416 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.5 tp -46.29 133.79 9.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 111.253 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 2.2 mp -93.98 39.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.001 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.466 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.85 35.89 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -97.06 84.08 0.77 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.363 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 39.3 mm 68.73 -69.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.712 0.291 . . . . 0.0 111.213 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -93.71 92.54 7.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.881 0.372 . . . . 0.0 111.235 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.466 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt85 -50.96 -23.12 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.232 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.482 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 4.4 tt0 -45.0 155.63 0.11 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.425 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.31 -167.88 26.6 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.626 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.407 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.4 mmm -126.24 143.24 51.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.425 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 7.3 ttt180 -146.69 141.43 26.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.383 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.8 t -77.15 143.16 39.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 28.5 p -98.46 30.61 3.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.877 0.37 . . . . 0.0 110.724 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -139.14 -40.37 0.47 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.121 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.7 m -110.37 -17.67 13.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.67 -5.0 85.77 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.67 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.425 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 12.4 p -54.5 142.86 7.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 O-C-N 122.734 -0.274 . . . . 0.0 111.023 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.7 mttp -126.53 140.44 52.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.857 0.361 . . . . 0.0 110.801 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.56 177.97 9.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.05 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -75.31 176.82 7.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.08 -41.85 94.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.514 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -38.76 13.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.035 0.445 . . . . 0.0 111.142 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 88.4 m -59.03 -20.52 53.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.12 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.02 -42.0 75.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.994 0.426 . . . . 0.0 110.385 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.6 -33.93 58.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.138 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 56.4 mt -71.04 -30.21 66.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.978 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.3 tt -57.56 146.19 31.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.097 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -71.67 116.89 12.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -85.24 146.02 27.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.141 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -176.64 40.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.821 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.862 0.363 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.2 m-70 -60.3 126.56 27.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -77.8 62.66 2.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.126 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.463 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 36.7 m-85 -61.35 114.88 3.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.323 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.7 pp20? -113.7 153.7 28.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.077 179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.3 105.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 111.071 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.494 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.42 130.81 53.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.272 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.495 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -93.39 119.61 32.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.412 . . . . 0.0 110.913 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.494 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.31 109.49 1.92 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.261 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.2 p -72.12 -27.86 62.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.022 0.439 . . . . 0.0 109.982 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 2.7 p -133.4 162.23 58.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.911 179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -47.5 110.45 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.413 2.075 . . . . 0.0 112.053 179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 93.7 m -125.68 130.97 52.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.192 -179.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 28.4 m-85 -84.25 156.12 22.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.925 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.4 t -85.44 123.13 30.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.912 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.418 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -62.96 -14.09 42.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -88.99 -57.66 2.82 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.37 13.16 20.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 13.5 mt-10 47.42 51.35 13.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.27 122.81 4.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.951 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.428 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.4 tp -46.25 134.36 8.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 111.288 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.409 HD21 ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.12 38.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.65 -167.89 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.81 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 111.78 -77.51 0.24 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.515 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 4.4 mp -129.28 -61.69 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 111.097 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.25 90.31 4.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.2 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER -54.15 -21.8 9.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.119 179.608 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.495 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 1.1 tt0 -43.14 154.48 0.07 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.682 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.76 -163.71 22.15 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.689 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.6 mmm -129.44 144.56 51.3 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.426 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 22.5 ttt-85 -146.65 140.48 26.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.974 0.416 . . . . 0.0 111.308 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.5 t -75.67 142.77 42.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.397 179.37 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 19.4 p -98.49 30.97 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.654 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -139.37 -40.01 0.47 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.239 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.16 -20.58 12.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.56 -5.18 82.51 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.684 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.426 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 12.0 p -54.36 145.67 4.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 CA-C-N 116.744 0.272 . . . . 0.0 110.954 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.464 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.73 141.13 51.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.895 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.6 p -148.42 178.06 8.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.125 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.409 ' CD2' HD21 ' A' ' 587' ' ' LEU . 40.8 m80 -74.97 175.76 7.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.354 179.526 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -63.63 -37.7 88.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.593 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 8.3 tttt -90.47 -40.3 12.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.952 0.406 . . . . 0.0 111.184 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 13.4 m -58.24 -19.87 37.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.398 -179.623 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -54.97 -33.69 62.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.965 0.412 . . . . 0.0 110.606 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -90.44 -33.8 15.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.38 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 4.7 mt -71.27 -29.52 65.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.04 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 tt -58.59 144.56 42.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.107 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 -65.5 -174.15 0.18 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.784 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -130.92 142.13 50.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.136 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -176.18 39.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.918 179.95 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.802 0.334 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.4 m-70 -58.87 131.55 51.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.976 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -73.66 63.39 0.84 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.113 0.482 . . . . 0.0 110.187 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.466 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 28.9 m-85 -66.47 115.77 6.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.292 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -114.23 155.09 26.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.113 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 33.4 t -62.37 105.21 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.952 0.406 . . . . 0.0 111.044 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.493 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.14 132.59 54.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.18 119.24 34.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.943 0.401 . . . . 0.0 110.857 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.493 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.08 109.48 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.094 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 1.9 p -70.78 -30.25 66.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.114 0.483 . . . . 0.0 110.017 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 1.4 p -131.64 162.98 52.93 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.952 179.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_endo -48.1 110.54 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.465 2.11 . . . . 0.0 112.146 179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 52.9 m -125.48 134.29 52.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.148 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -85.08 156.06 21.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.852 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.53 ' O ' ' N ' ' A' ' 584' ' ' GLU . 51.4 t -87.9 120.53 29.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.991 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.412 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -58.87 -18.08 29.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.351 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -83.02 -57.7 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -179.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.1 p -114.98 14.28 17.14 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.4 mt-10 46.97 51.45 12.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.58 123.49 5.11 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.938 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.412 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.1 tp -46.26 131.59 10.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.85 0.357 . . . . 0.0 111.207 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . . . . . . . . . 1.9 mp -93.48 42.72 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.448 ' CZ3' ' HB2' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.47 29.32 7.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -87.3 80.47 1.71 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.376 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 19.4 mt 69.32 -66.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.777 0.322 . . . . 0.0 111.185 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -94.49 91.88 6.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.448 ' HB2' ' CZ3' ' A' ' 588' ' ' TRP . 3.0 ptt180 -49.53 -24.73 2.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.282 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.1 tt0 -45.02 152.6 0.23 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.695 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.71 -158.92 10.68 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.423 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 63.9 mmm -131.32 144.66 51.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.0 ttt-85 -146.51 140.7 26.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.961 0.41 . . . . 0.0 111.316 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 51.8 t -76.72 142.22 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 29.8 p -97.85 30.52 2.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.954 0.406 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -137.72 -40.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.013 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -111.86 -16.94 13.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.133 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.8 -3.91 86.66 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.689 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 596' ' ' ARG . 11.4 p -54.58 145.36 4.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.555 0.217 . . . . 0.0 111.01 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.456 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.57 140.51 51.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.94 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.8 p -148.59 178.0 9.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 47.2 m80 -75.04 174.9 8.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.394 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -63.52 -38.17 90.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.608 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -34.49 15.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.922 0.391 . . . . 0.0 111.328 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 7.9 m -62.67 -19.2 63.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.251 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -54.8 -34.14 62.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.982 0.42 . . . . 0.0 110.633 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.07 -35.69 15.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.396 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 7.5 mt -68.2 -30.09 69.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.28 151.41 19.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 11.6 p30 -80.09 127.02 31.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.858 179.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -83.33 147.91 27.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.155 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -176.41 39.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.867 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.958 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.778 0.323 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.3 m-70 -58.4 134.75 56.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.72 61.77 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.139 0.495 . . . . 0.0 110.034 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.454 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 26.0 m-85 -62.13 121.77 13.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.583 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -120.64 152.87 37.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.167 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.37 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.976 0.417 . . . . 0.0 111.25 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.11 130.01 52.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.299 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.516 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.1 m -91.98 119.97 32.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.857 0.36 . . . . 0.0 110.844 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.37 109.35 1.57 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.127 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 11.5 p -70.45 -26.05 63.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.118 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 13.9 p -139.4 161.05 59.28 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.81 179.336 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_exo -44.35 111.14 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.339 2.026 . . . . 0.0 112.418 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 87.5 m -125.72 135.33 51.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -88.41 156.03 19.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.159 -179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.3 t -85.26 126.06 33.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.85 -11.41 46.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -91.53 -57.65 2.69 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.47 10.12 19.68 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mm-40 50.13 50.36 18.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.52 120.64 4.37 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.971 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.408 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 14.4 tp -46.26 131.58 10.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.874 0.369 . . . . 0.0 111.415 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.456 ' CD2' ' CD2' ' A' ' 605' ' ' HIS . 2.4 mp -93.03 44.8 1.16 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.591 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -113.03 -165.45 0.99 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.832 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.46 -75.15 0.21 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.466 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 2.7 mp -130.42 -61.09 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.45 90.37 4.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.249 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.9 OUTLIER -53.86 -21.65 8.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.196 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.516 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 10.2 tt0 -41.23 153.36 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.808 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.65 -171.53 33.74 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.551 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.454 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 64.4 mmm -122.05 144.72 48.74 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.41 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt-85 -146.45 140.02 25.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 111.277 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 52.3 t -76.23 142.34 41.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.454 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 14.9 p -97.18 29.96 2.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.944 0.402 . . . . 0.0 110.699 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -137.98 -42.01 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.024 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.4 m -111.74 -18.4 12.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.135 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.19 -2.83 86.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.431 HG13 ' CE1' ' A' ' 569' ' ' PHE . 9.6 p -55.78 132.59 19.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 110.958 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.7 OUTLIER -115.71 140.38 49.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.989 0.423 . . . . 0.0 110.936 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.62 178.12 8.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.088 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.456 ' CD2' ' CD2' ' A' ' 587' ' ' LEU . 36.6 m80 -75.63 176.57 7.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.32 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.21 -37.66 88.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.626 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.48 -41.52 11.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.951 0.405 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 13.2 m -56.96 -21.01 26.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.386 -179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -53.21 -35.98 60.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.832 0.349 . . . . 0.0 110.796 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.47 -35.42 15.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.552 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 6.7 mt -69.84 -28.1 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.8 155.56 10.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.059 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -79.87 132.31 36.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.762 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -89.64 146.37 24.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.93 39.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.886 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.821 0.344 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.2 m-70 -59.69 136.41 57.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.998 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.89 63.51 1.72 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.102 0.477 . . . . 0.0 110.041 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.472 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 30.8 m-85 -61.42 120.83 11.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.61 150.72 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.31 105.39 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.88 0.371 . . . . 0.0 111.049 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.528 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.52 129.34 51.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.48 179.859 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.476 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.5 m -95.83 117.38 30.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.907 0.384 . . . . 0.0 110.606 179.427 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.528 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.48 111.07 2.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.244 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 22.3 p -69.8 -24.09 63.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.001 0.429 . . . . 0.0 110.238 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 34.9 p -136.87 159.43 70.19 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.151 179.336 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -46.02 112.11 0.41 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.48 2.12 . . . . 0.0 112.433 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 52.0 m -129.2 135.45 48.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -84.75 156.04 21.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.229 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.0 t -86.73 121.4 29.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.413 ' CG ' HG21 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -59.98 -17.07 35.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.234 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.85 -57.74 2.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.18 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.8 p -112.99 13.38 19.48 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.2 mt-10 46.77 49.62 14.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 111.169 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.19 124.73 5.57 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.938 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.424 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.3 tp -46.2 134.47 8.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.298 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.6 mp -94.11 39.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.55 37.34 2.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -99.15 84.8 0.65 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.364 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 27.5 mt 68.63 -69.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.678 0.275 . . . . 0.0 111.199 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -93.95 92.25 7.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.932 0.396 . . . . 0.0 111.297 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.3 OUTLIER -50.78 -23.53 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.137 179.556 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.476 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.1 OUTLIER -45.22 153.38 0.21 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 -179.942 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.14 -172.54 31.74 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.472 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 71.9 mmm -121.18 144.58 48.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.65 0.262 . . . . 0.0 110.314 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.413 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.1 ttt180 -146.68 141.21 26.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 111.197 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 52.6 t -76.83 144.31 39.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.478 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.6 p -98.96 30.85 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.955 0.407 . . . . 0.0 110.756 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -140.89 -40.37 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.178 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.49 -18.44 13.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.08 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.71 -5.67 84.35 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.632 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.413 HG21 ' CG ' ' A' ' 581' ' ' TYR . 14.4 p -54.69 142.63 8.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.61 0.243 . . . . 0.0 111.073 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.474 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.1 mttm -125.68 140.79 52.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.799 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -148.71 177.92 9.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.416 ' CD2' HD22 ' A' ' 587' ' ' LEU . 49.4 m80 -75.37 174.38 9.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.217 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.02 -32.91 74.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 33.3 tttm -90.7 -43.85 9.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.046 0.451 . . . . 0.0 111.076 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.9 m -60.34 -24.77 65.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.429 -179.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.18 -28.4 62.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.352 . . . . 0.0 110.675 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -91.08 -31.35 16.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.448 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 3.4 mt -77.08 -30.9 55.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.2 tt -57.22 141.49 46.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -60.5 -171.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.799 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.435 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -134.59 140.25 45.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.19 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -156.0 39.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.843 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.88 0.372 . . . . 0.0 111.159 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.2 m-70 -58.64 131.49 51.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.004 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -77.65 62.44 2.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 110.024 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.466 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 31.1 m-85 -61.48 124.53 20.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.492 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -124.12 154.01 40.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.208 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 27.9 t -62.4 105.46 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.948 0.404 . . . . 0.0 111.149 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.511 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.2 OUTLIER -122.95 134.34 54.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.313 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.5 121.18 38.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.381 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.511 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.3 109.41 2.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.131 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 5.3 p -71.05 -25.83 62.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.092 0.472 . . . . 0.0 109.995 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 6.5 p -136.42 161.09 64.11 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.782 179.25 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -47.71 110.48 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.504 2.136 . . . . 0.0 112.05 -179.969 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 94.8 m -124.77 136.8 54.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.182 -179.805 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -86.8 156.14 20.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.523 ' O ' ' N ' ' A' ' 584' ' ' GLU . 53.2 t -89.44 119.65 30.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.416 ' CG ' HG21 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -59.36 -18.2 36.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.388 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.32 -57.86 3.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.131 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 31.8 p -113.48 13.57 18.89 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.1 OUTLIER 46.9 51.57 12.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.808 0.337 . . . . 0.0 111.092 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.98 123.13 4.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.952 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.426 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.1 tp -46.14 133.81 8.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.319 . . . . 0.0 111.445 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.409 HD21 ' CD2' ' A' ' 605' ' ' HIS . 2.8 mp -94.27 43.03 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.662 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.471 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -111.86 -165.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.863 -179.778 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.83 -73.01 0.2 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.498 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 23.4 mt -133.77 -60.68 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.744 0.307 . . . . 0.0 111.114 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.88 90.27 3.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.93 0.395 . . . . 0.0 111.246 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.471 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 2.8 ptt85 -54.17 -21.46 8.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.222 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.49 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 16.8 tt0 -41.35 155.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.779 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.31 -170.14 35.06 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.584 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.415 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.9 mmm -122.28 145.99 47.71 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.429 -0.211 . . . . 0.0 110.429 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 9.5 ttt180 -146.53 141.87 27.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 111.386 -179.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 48.6 t -79.12 140.41 37.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.201 179.207 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 69.7 p -97.27 30.92 2.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.005 0.431 . . . . 0.0 110.54 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -136.95 -40.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.22 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.1 m -112.37 -22.24 10.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.272 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 94.08 -5.47 72.0 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.734 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.416 HG21 ' CG ' ' A' ' 581' ' ' TYR . 11.4 p -54.5 144.55 5.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.685 0.278 . . . . 0.0 110.958 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.484 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.9 mttp -127.65 140.13 52.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.899 0.381 . . . . 0.0 110.727 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.47 177.97 9.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.023 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.409 ' CD2' HD21 ' A' ' 587' ' ' LEU . 45.2 m80 -75.06 -177.06 3.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.233 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.9 tt0 -73.46 -35.66 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.464 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -34.73 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 27.6 m -67.57 -23.8 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.372 -179.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.39 -28.51 66.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.886 0.374 . . . . 0.0 110.622 179.733 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -88.79 -33.43 17.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.328 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 5.9 mt -76.57 -30.16 56.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.088 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.6 tt -57.23 145.49 31.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.142 -179.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -62.42 -174.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.82 179.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.4 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -149.81 143.14 25.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.037 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -165.45 39.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.937 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.447 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.9 m-70 -58.99 140.72 55.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.902 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -75.25 62.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.127 0.489 . . . . 0.0 110.094 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.454 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.8 m-85 -61.99 116.76 5.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.5 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -116.96 151.39 36.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.279 179.523 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 30.1 t -62.49 105.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 111.087 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.516 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -124.44 130.21 52.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.365 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.512 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -94.52 119.04 32.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.764 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.516 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -62.93 110.42 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.117 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 9.7 p -71.94 -26.25 62.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.092 0.472 . . . . 0.0 109.965 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 43.3 p -136.03 159.46 70.97 Favored Pre-proline 0 N--CA 1.454 -0.243 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.967 179.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -45.38 111.39 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.45 2.1 . . . . 0.0 112.497 -179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 92.7 m -127.28 138.39 53.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.06 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -89.01 156.09 19.08 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.061 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.496 ' O ' ' N ' ' A' ' 584' ' ' GLU . 43.2 t -88.25 122.33 31.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CG ' HG22 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -61.54 -16.39 47.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.269 179.717 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -84.17 -57.62 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.3 p -116.04 16.03 16.09 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.9 mp0 45.84 52.21 9.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 111.247 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.36 122.86 4.76 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.071 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.433 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 16.4 tp -46.35 135.92 7.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.267 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.418 HD22 ' CD2' ' A' ' 605' ' ' HIS . 2.5 mp -95.43 39.88 1.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -109.23 -167.81 1.26 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.779 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.54 -76.59 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.548 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 36.6 mt -129.95 -61.14 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.729 0.3 . . . . 0.0 111.146 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.91 90.21 4.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.41 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.8 OUTLIER -55.23 -21.42 14.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.191 179.67 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.512 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.2 tt0 -42.99 153.82 0.08 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.592 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.96 -168.67 29.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.796 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.454 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.7 mmm -125.79 144.1 50.78 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.401 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 9.5 ttt180 -146.66 141.09 26.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.036 0.446 . . . . 0.0 111.57 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 42.5 t -79.0 144.24 34.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.228 178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 3.8 p -99.61 32.15 2.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 0.0 110.569 179.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -139.25 -41.2 0.46 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.155 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.68 -17.36 13.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.49 -6.02 83.22 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.657 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.417 HG22 ' CG ' ' A' ' 581' ' ' TYR . 14.3 p -54.53 142.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.757 0.313 . . . . 0.0 111.068 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -126.12 141.45 51.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.666 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.1 p -148.32 178.05 8.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.418 ' CD2' HD22 ' A' ' 587' ' ' LEU . 47.2 m80 -76.65 177.36 7.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.184 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.1 -59.32 5.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.576 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -36.48 64.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 0.0 111.597 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.8 m -57.77 -21.46 41.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.48 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -55.32 -35.43 65.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.9 0.381 . . . . 0.0 110.801 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 -35.46 18.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.72 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt -71.09 -29.43 65.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.057 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 3.1 tt -58.28 150.86 20.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.997 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 37.2 m-20 -72.56 128.44 35.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . 0.405 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -90.24 147.11 23.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.103 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -168.98 39.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.842 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.927 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.867 0.365 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' HIS . . . . . 0.421 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 96.7 m-70 -67.46 131.1 45.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -75.21 64.32 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.178 0.513 . . . . 0.0 109.915 179.341 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' PHE . . . . . 0.441 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 23.1 m-85 -61.48 125.74 24.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.675 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -128.39 153.81 46.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.219 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.38 105.41 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 0.0 111.147 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' TRP . . . . . 0.537 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -123.6 132.93 53.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.374 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' THR . . . . . 0.447 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.2 m -99.75 117.36 33.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.648 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' ALA . . . . . 0.537 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -65.82 118.25 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.319 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.5 p -77.06 -26.51 53.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.168 0.509 . . . . 0.0 110.053 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 64.1 p -131.95 157.93 76.88 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.912 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' PRO . . . . . . . . . . . . . 2.6 Cg_endo -45.85 111.37 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.666 2.244 . . . . 0.0 112.193 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' THR . . . . . . . . . . . . . 33.9 m -127.61 131.91 49.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 -179.842 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -82.99 156.09 23.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.151 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -85.68 122.12 29.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' TYR . . . . . 0.425 ' CD2' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.43 -13.96 35.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.395 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.09 -57.64 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.4 4.94 24.93 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.8 OUTLIER 53.93 48.94 20.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.57 126.09 5.6 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.949 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' LEU . . . . . 0.431 ' CD2' ' HB2' ' A' ' 588' ' ' TRP . 15.0 tp -46.31 134.42 8.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 111.234 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 587' ' ' LEU . . . . . 0.451 ' CD2' ' CD2' ' A' ' 605' ' ' HIS . 0.9 OUTLIER -94.53 39.62 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.802 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.32 30.15 6.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.22 81.16 1.6 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.26 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 7.9 mt 68.68 -68.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.735 0.303 . . . . 0.0 111.086 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -91.54 93.2 8.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.919 0.39 . . . . 0.0 111.134 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.1 ptt180 -51.87 -22.97 4.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.306 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 593' ' ' GLN . . . . . 0.447 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 34.4 tt0 -45.62 154.76 0.19 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.397 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.45 -163.62 21.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.699 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 595' ' ' MET . . . . . 0.441 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 69.3 mmm -126.79 144.99 50.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.353 -0.239 . . . . 0.0 110.353 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 596' ' ' ARG . . . . . 0.418 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 0.2 OUTLIER -145.63 141.78 28.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.974 0.416 . . . . 0.0 111.228 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 597' ' ' CYS . . . . . . . . . . . . . 50.5 t -78.92 142.21 36.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.237 179.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.9 p -98.38 31.32 2.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.992 0.425 . . . . 0.0 110.564 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -139.42 -40.76 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.224 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.0 m -112.41 -21.21 11.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.253 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 92.41 -4.6 76.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.623 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 602' ' ' VAL . . . . . 0.425 HG23 ' CD2' ' A' ' 581' ' ' TYR . 8.0 p -54.41 140.84 11.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.632 0.253 . . . . 0.0 110.876 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 603' ' ' LYS . . . . . 0.453 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -124.88 139.82 53.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.856 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -148.71 177.88 9.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.066 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 605' ' ' HIS . . . . . 0.451 ' CD2' ' CD2' ' A' ' 587' ' ' LEU . 54.3 m80 -75.86 177.73 6.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.283 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -67.48 -35.23 78.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.285 -179.655 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -90.85 -47.32 7.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 91.0 m -59.44 -22.35 61.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.497 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -57.8 -31.09 66.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.866 0.365 . . . . 0.0 110.434 179.746 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.28 -30.46 18.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.393 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 13.9 mt -75.9 -27.97 57.88 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.133 179.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.8 tt -54.5 145.49 18.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.271 -179.69 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -78.57 126.18 30.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -68.16 150.37 48.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.087 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -172.38 39.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.879 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.477 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 4.6 t30 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 121.044 0.449 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.727 ' CE1' HG13 ' A' ' 602' ' ' VAL . 32.7 m-85 -61.45 117.58 5.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.399 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.558 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -114.57 155.89 25.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.15 179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.33 105.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.931 0.396 . . . . 0.0 111.148 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -121.64 132.44 54.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.317 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.538 HG22 ' CD ' ' A' ' 592' ' ' ARG . 7.4 m -97.23 120.63 37.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.48 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.36 109.31 2.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.136 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 24.5 p -72.0 -25.6 61.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.443 . . . . 0.0 110.073 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 22.6 p -136.42 159.68 69.72 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.87 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.509 ' CB ' HD11 ' A' ' 586' ' ' LEU . 1.8 Cg_endo -45.28 110.5 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.555 2.17 . . . . 0.0 112.08 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.805 ' O ' HD12 ' A' ' 587' ' ' LEU . 72.1 m -127.45 137.34 52.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.052 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 579' ' ' TYR . . . . . 0.441 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -89.49 156.22 18.78 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.126 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -84.41 126.01 32.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.982 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.705 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.95 -13.31 56.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.136 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -57.62 2.87 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.827 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.2 p -114.87 13.52 17.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 580' ' ' CYS . 12.5 mm-40 47.96 51.26 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.7 123.52 5.26 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.027 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.509 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.0 tp -46.29 134.34 8.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.816 0.341 . . . . 0.0 111.23 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.805 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -95.04 40.74 1.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.941 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' HB2' ' CD2' ' A' ' 586' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.781 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.538 ' CD ' HG22 ' A' ' 573' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 CA-C-O 120.683 0.277 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.537 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 13.4 tt0 -42.46 158.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.663 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.44 -166.97 31.02 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.561 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 62.3 mmm -127.38 143.61 51.19 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 5.8 ttt180 -146.62 141.13 26.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.979 0.419 . . . . 0.0 111.476 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.592 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.0 t -76.85 143.1 39.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.276 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 570' ' ' GLU . 3.1 p -98.38 30.75 3.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.941 0.401 . . . . 0.0 110.765 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -139.51 -39.44 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.31 -18.89 12.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.241 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.58 -5.06 85.06 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.614 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.727 HG13 ' CE1' ' A' ' 569' ' ' PHE . 10.3 p -54.44 144.25 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.635 0.218 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.34 141.34 51.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.861 0.363 . . . . 0.0 110.981 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.7 p -148.55 178.08 8.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.417 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.1 m80 -75.59 177.13 7.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.264 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.62 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.51 -36.31 14.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.932 0.396 . . . . 0.0 111.384 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.787 ' HA ' HD12 ' A' ' 611' ' ' LEU . 18.0 m -61.55 -19.9 62.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.359 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.13 -34.07 65.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.0 -33.77 18.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.787 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.4 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.062 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.558 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 121.169 0.509 . . . . 0.0 109.944 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.501 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 27.4 m-85 -61.39 117.58 5.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.639 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.498 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -118.74 150.83 39.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.099 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.52 105.39 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.974 0.416 . . . . 0.0 111.148 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.547 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.3 OUTLIER -122.44 126.81 48.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.225 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.1 m -91.38 118.09 30.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.995 0.426 . . . . 0.0 110.823 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.547 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.9 109.45 1.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.7 p -70.19 -28.74 65.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.128 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.1 p -132.94 162.52 57.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.971 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.589 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.6 Cg_endo -48.21 110.48 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.508 2.139 . . . . 0.0 111.998 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.785 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.1 m -126.33 134.19 51.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.05 156.07 21.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.121 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.49 ' O ' ' N ' ' A' ' 584' ' ' GLU . 45.2 t -86.84 123.1 31.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.843 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.646 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.22 -15.52 47.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.29 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -85.54 -57.6 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.2 p -114.67 14.23 17.53 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.49 ' N ' ' O ' ' A' ' 580' ' ' CYS . 3.6 mt-10 47.22 51.74 12.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.122 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.4 123.04 4.99 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.051 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.589 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.22 134.15 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 0.0 111.242 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.785 HD12 ' O ' ' A' ' 578' ' ' THR . 1.7 mp -94.01 39.51 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.6 ptt180 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.713 0.292 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.555 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 7.1 tt0 -42.75 152.4 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.682 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.16 -172.71 32.94 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.572 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.501 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.08 145.98 47.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.556 0.217 . . . . 0.0 110.427 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 6.9 ttt180 -146.68 141.49 26.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.401 . . . . 0.0 111.223 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.558 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 51.0 t -77.71 144.12 37.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.505 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.498 HG22 ' HG2' ' A' ' 570' ' ' GLU . 16.4 p -99.18 31.3 3.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.935 0.398 . . . . 0.0 110.688 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -140.37 -40.77 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.217 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.5 m -110.44 -18.81 13.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.127 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.99 -5.22 85.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.573 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.646 HG23 ' CG ' ' A' ' 581' ' ' TYR . 15.0 p -54.57 143.93 6.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.648 0.261 . . . . 0.0 111.029 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.459 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -126.18 140.31 52.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.726 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -148.59 178.09 8.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.1 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 47.3 m80 -74.89 -176.89 3.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.285 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 606' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.2 tm-20 -72.61 -36.08 68.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.786 0.327 . . . . 0.0 111.315 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -90.68 -46.24 8.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.723 ' HA ' HD12 ' A' ' 611' ' ' LEU . 56.3 m -58.12 -24.79 60.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.356 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 609' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.2 OUTLIER -57.92 -30.61 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 110.53 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -86.61 -31.29 21.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.304 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.0 mt . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.522 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 47.7 t30 . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 121.196 0.522 . . . . 0.0 109.924 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.715 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.4 m-85 -61.12 121.86 13.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.466 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.532 ' CD ' HG21 ' A' ' 598' ' ' THR . 63.5 mt-10 -121.4 153.74 37.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.153 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.39 105.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.956 0.408 . . . . 0.0 111.201 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.476 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -122.05 130.47 53.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.185 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 18.4 m -94.77 120.62 35.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.889 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.476 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.29 109.35 1.86 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.013 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 55.4 p -68.9 -26.21 64.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.09 0.472 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 5.1 p -140.37 161.74 53.39 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.873 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.751 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.4 Cg_exo -44.05 110.78 0.22 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.414 2.076 . . . . 0.0 112.426 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.774 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.8 m -127.71 134.34 49.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -84.4 156.09 21.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.079 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.561 ' O ' ' N ' ' A' ' 584' ' ' GLU . 41.7 t -90.33 118.07 29.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.783 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -56.83 -20.36 22.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.368 179.769 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -78.11 -57.69 3.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.165 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.9 p -117.71 16.28 14.46 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 580' ' ' CYS . 56.2 mt-10 46.26 52.07 10.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.753 0.311 . . . . 0.0 111.128 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.12 123.03 4.87 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.013 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.751 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.9 tp -46.3 133.24 9.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.783 0.325 . . . . 0.0 111.245 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.774 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -93.73 41.94 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.79 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.708 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.3 ptt180 . . . . . 0 CA--C 1.53 0.184 0 CA-C-O 120.651 0.262 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 44.4 tt0 -41.41 156.15 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.716 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -170.0 -171.07 35.14 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.594 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.3 mmm -123.4 144.52 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 14.4 ttt180 -146.78 141.05 26.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.416 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.524 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.1 t -79.04 141.09 37.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.168 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.532 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.0 p -96.84 29.73 2.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.384 . . . . 0.0 110.775 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.42 -41.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.903 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.3 m -113.42 -21.04 11.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.096 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.67 3.96 76.75 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.653 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.715 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.3 p -60.83 119.4 4.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.467 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -104.85 138.76 40.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.835 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.1 p -148.66 177.94 9.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.941 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -74.14 -177.45 2.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.273 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 606' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -73.36 -33.07 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.704 0.288 . . . . 0.0 111.229 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -90.69 -33.53 15.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.743 ' HA ' HD12 ' A' ' 611' ' ' LEU . 53.0 m -68.66 -25.4 64.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.424 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 609' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.1 OUTLIER -57.18 -27.87 62.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.85 0.357 . . . . 0.0 110.684 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.26 -32.31 15.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.534 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.0 mt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.061 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.54 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 23.0 t30 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 121.097 0.475 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.479 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.4 m-85 -61.48 113.76 2.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -114.55 152.07 32.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.023 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.6 t -62.4 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 111.253 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.707 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.23 131.19 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.242 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -96.92 117.33 30.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.707 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.56 112.17 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.076 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 61.8 p -72.78 -29.22 63.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.054 0.455 . . . . 0.0 110.077 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.3 p -130.1 162.16 55.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.53 ' CB ' HD11 ' A' ' 586' ' ' LEU . 6.7 Cg_endo -49.19 110.44 0.36 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.46 2.107 . . . . 0.0 112.093 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.584 ' O ' HD12 ' A' ' 587' ' ' LEU . 88.7 m -126.17 140.71 52.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -92.02 156.09 17.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.258 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 584' ' ' GLU . 46.4 t -84.21 122.98 29.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.804 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.688 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -62.17 -15.08 43.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.234 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.54 -57.58 2.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -114.7 14.05 17.46 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 580' ' ' CYS . 41.7 mt-10 47.53 51.57 13.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.033 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.32 122.1 4.81 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.949 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.53 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.31 133.78 9.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.81 0.338 . . . . 0.0 111.43 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.615 HD23 ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.38 41.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.878 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.674 0.273 . . . . 0.0 111.133 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.3 tt0 -43.56 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.666 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -168.51 -169.75 32.33 Favored Glycine 0 C--N 1.33 0.201 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.603 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.479 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 68.1 mmm -124.32 144.25 50.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 13.2 ttt180 -146.7 141.43 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.986 0.422 . . . . 0.0 111.274 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.558 ' HB3' HG12 ' A' ' 602' ' ' VAL . 49.2 t -76.96 143.81 39.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.318 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 31.31 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.403 . . . . 0.0 110.646 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -140.05 -40.39 0.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.8 m -110.23 -19.45 13.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.025 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.65 -5.76 84.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.703 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.688 HG23 ' CG ' ' A' ' 581' ' ' TYR . 13.5 p -54.45 145.82 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.613 0.244 . . . . 0.0 111.087 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -127.72 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 110.739 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.58 178.08 8.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.615 ' CD2' HD23 ' A' ' 587' ' ' LEU . 38.6 m80 -76.94 177.94 7.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.421 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.58 -38.02 89.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.735 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -41.49 11.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.083 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.583 ' HA ' HD12 ' A' ' 611' ' ' LEU . 58.8 m -56.99 -20.97 26.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.508 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -54.65 -35.64 63.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -87.84 -33.77 18.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.47 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 608' ' ' CYS . 10.6 mt . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.984 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.54 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.9 t30 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 121.114 0.483 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.731 ' HE1' HG13 ' A' ' 602' ' ' VAL . 25.7 m-85 -61.52 117.3 5.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.715 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.77 154.02 31.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.997 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.35 105.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.015 0.436 . . . . 0.0 111.382 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.746 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.24 129.41 52.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.361 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.523 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.7 m -96.09 117.5 30.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.381 . . . . 0.0 110.615 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.746 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.62 111.77 2.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.234 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 23.4 p -71.85 -24.14 61.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.119 0.485 . . . . 0.0 110.162 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 4.0 p -134.99 161.16 65.34 Favored Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.016 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.548 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.33 111.15 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.614 2.209 . . . . 0.0 112.103 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 587' ' ' LEU . 44.2 m -128.68 133.75 48.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 579' ' ' TYR . . . . . 0.477 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.4 m-85 -85.22 156.16 21.1 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.255 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 584' ' ' GLU . 47.8 t -85.4 122.36 29.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.514 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -60.82 -16.6 42.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.387 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.38 -57.71 3.04 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.4 p -113.18 13.71 19.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.2 mm-40 47.19 51.43 13.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 111.134 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.48 125.72 5.69 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.524 -0.845 . . . . 0.0 112.969 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.548 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.3 tp -46.25 134.68 8.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.112 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 578' ' ' THR . 2.1 mp -94.55 38.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.949 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.172 0 CA-C-O 120.748 0.309 . . . . 0.0 111.238 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.523 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.8 tt0 -45.89 149.99 0.6 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.387 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -161.29 -169.88 25.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.6 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.471 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 66.7 mmm -123.08 145.45 48.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.7 ttt180 -146.74 141.69 27.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.857 0.36 . . . . 0.0 111.107 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.54 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 51.5 t -78.08 143.46 37.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.409 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.2 p -98.92 31.41 2.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.601 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.95 -41.36 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.47 -22.7 10.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.999 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 89.37 7.57 69.42 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.646 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.731 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.6 p -65.05 122.38 15.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.843 0.354 . . . . 0.0 110.841 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.47 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.9 OUTLIER -105.87 139.71 40.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.935 0.398 . . . . 0.0 110.877 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.2 p -148.46 177.96 9.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.403 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 45.6 m80 -74.69 175.91 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.204 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -37.84 88.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.414 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -90.64 -37.96 13.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.897 0.38 . . . . 0.0 111.264 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.504 ' HA ' HD12 ' A' ' 611' ' ' LEU . 14.5 m -60.04 -19.65 53.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.449 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -54.74 -32.83 60.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.901 0.381 . . . . 0.0 110.639 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.66 -33.9 14.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.515 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.9 mt . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.049 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.596 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.178 0.513 . . . . 0.0 109.904 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.663 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.9 m-85 -65.76 123.91 21.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.605 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.586 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -124.52 149.76 46.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.167 179.537 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.5 105.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 111.31 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.85 134.91 54.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.251 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 3.4 m -96.03 121.38 37.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 110.93 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.537 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.72 109.44 3.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 45.4 p -70.1 -26.69 64.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.118 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.415 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 19.5 p -137.08 160.49 65.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.068 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.806 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.6 Cg_exo -45.33 110.9 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.327 2.018 . . . . 0.0 112.35 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 99.8 m -126.4 129.92 49.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.08 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 579' ' ' TYR . . . . . 0.497 ' CE1' HD13 ' A' ' 586' ' ' LEU . 29.7 m-85 -83.66 156.02 22.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.172 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.5 t -84.21 125.17 31.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.494 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.54 -12.37 43.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -89.37 -57.57 2.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.6 p -114.75 14.28 17.44 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.6 mm-40 47.74 51.46 14.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.846 0.355 . . . . 0.0 110.965 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.03 120.54 4.5 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.974 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.7 tp -46.3 134.41 8.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 111.315 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.62 39.75 1.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.763 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.801 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.4 ptp180 . . . . . 0 CA--C 1.529 0.148 0 CA-C-O 120.703 0.287 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 17.3 tt0 -43.04 156.66 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.75 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -169.32 -170.37 33.79 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.465 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.52 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.91 146.26 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -146.7 140.78 26.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.063 0.459 . . . . 0.0 111.105 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.596 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 54.0 t -76.47 144.61 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.585 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.586 HG22 ' HG2' ' A' ' 570' ' ' GLU . 10.4 p -98.65 30.35 3.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.0 110.88 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -141.29 -40.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.035 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.7 m -112.39 -18.78 12.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 82.96 8.97 85.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.569 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.663 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.8 p -65.73 119.47 10.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -101.67 138.54 38.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.936 0.398 . . . . 0.0 111.001 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.71 178.07 8.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.026 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.442 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.6 m80 -76.35 178.15 6.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.231 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.48 -52.09 64.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.594 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -82.46 -39.27 22.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.995 0.426 . . . . 0.0 111.223 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 90.6 m -56.76 -21.41 28.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.329 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -53.86 -41.5 67.56 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.26 -34.5 36.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.474 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 33.7 mt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.965 179.879 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.53 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 2.6 t30 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 121.097 0.475 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.638 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.5 m-85 -61.3 119.49 8.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.418 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.498 ' CD ' HG21 ' A' ' 598' ' ' THR . 61.6 mt-10 -118.93 155.22 31.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.233 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.37 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.409 . . . . 0.0 111.139 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.477 ' CH2' ' HD2' ' A' ' 603' ' ' LYS . 0.4 OUTLIER -123.43 123.19 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.249 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.789 HG22 ' HD2' ' A' ' 592' ' ' ARG . 22.3 m -89.71 116.96 28.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.827 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.469 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -59.3 109.43 0.87 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -25.13 64.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.174 0.511 . . . . 0.0 110.058 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.435 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 12.3 p -138.42 160.63 62.93 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.737 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.516 ' CB ' HD11 ' A' ' 586' ' ' LEU . 3.8 Cg_endo -46.72 110.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.517 2.145 . . . . 0.0 112.128 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.511 HG21 ' HZ3' ' A' ' 603' ' ' LYS . 96.9 m -127.66 134.34 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -83.33 156.14 23.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.008 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -88.13 118.56 27.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.763 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.429 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -57.38 -19.94 26.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.324 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -79.51 -57.79 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -116.65 16.8 15.41 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 580' ' ' CYS . 42.2 mt-10 45.75 51.75 10.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 0.0 111.221 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.64 124.47 5.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.89 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.516 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.33 133.83 9.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.853 0.358 . . . . 0.0 111.238 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 605' ' ' HIS . 0.5 OUTLIER -94.03 39.22 1.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.479 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.816 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.789 ' HD2' HG22 ' A' ' 573' ' ' THR . 8.3 ptt180 . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.77 0.319 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.6 tt0 -37.83 156.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.19 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.49 -175.95 40.2 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.446 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.2 mmm -122.31 144.6 48.9 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 10.4 ttt180 -146.61 141.52 27.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.891 0.377 . . . . 0.0 111.498 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.659 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.3 t -77.27 144.38 38.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.347 179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.498 HG21 ' CD ' ' A' ' 570' ' ' GLU . 13.5 p -99.01 31.03 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.954 0.407 . . . . 0.0 110.799 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.12 -40.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.253 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.0 m -111.17 -15.12 13.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.285 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 84.42 -4.08 84.87 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.699 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.659 HG12 ' HB3' ' A' ' 597' ' ' CYS . 9.2 p -54.58 142.45 8.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.675 0.274 . . . . 0.0 111.011 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.511 ' HZ3' HG21 ' A' ' 578' ' ' THR . 1.6 mttp -127.41 139.49 52.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.797 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.5 p -148.71 177.94 9.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.15 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.523 ' HA ' HD21 ' A' ' 587' ' ' LEU . 47.5 m80 -74.1 176.74 6.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.53 78.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.458 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -90.69 -43.54 10.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.043 0.449 . . . . 0.0 111.263 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 52.7 m -55.75 -22.13 22.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.657 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -55.74 -34.79 65.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.673 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -87.59 -32.36 19.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.476 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 20.2 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.979 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.586 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.4 t-20 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 121.101 0.477 . . . . 0.0 109.919 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.498 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 19.4 m-85 -64.87 120.34 12.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.666 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.469 ' HG2' HG23 ' A' ' 598' ' ' THR . 1.1 pt-20 -120.9 151.11 40.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.049 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.42 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.969 0.414 . . . . 0.0 111.238 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.777 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.22 130.69 53.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.347 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -96.68 117.47 31.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 110.835 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.777 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.31 112.37 3.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.8 p -72.25 -24.72 61.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.97 0.414 . . . . 0.0 110.256 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 21.9 p -136.39 160.19 67.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.155 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.743 ' HB3' HD11 ' A' ' 586' ' ' LEU . 85.8 Cg_exo -45.5 111.64 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.481 2.121 . . . . 0.0 112.564 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.722 ' O ' HD12 ' A' ' 587' ' ' LEU . 49.2 m -128.32 132.41 48.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -83.5 156.1 23.02 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.238 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.7 t -86.11 124.73 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.782 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -63.35 -13.87 43.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.267 179.864 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -88.14 -57.63 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.1 p -113.91 13.47 18.33 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 24.3 mt-10 47.78 46.48 18.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.856 0.36 . . . . 0.0 111.068 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -119.33 121.97 5.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.996 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.6 tp -46.23 135.81 7.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.816 0.341 . . . . 0.0 111.346 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.722 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -94.02 38.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.482 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.365 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.482 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.728 0.299 . . . . 0.0 111.504 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.529 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 8.8 tt0 -49.57 139.68 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.116 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -150.4 -167.77 14.74 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.675 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 74.8 mmm -120.14 146.18 46.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.603 0.239 . . . . 0.0 110.427 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.7 ttt180 -146.57 140.57 26.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.018 0.437 . . . . 0.0 111.358 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.646 ' HB3' HG12 ' A' ' 602' ' ' VAL . 54.1 t -78.86 140.5 38.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.469 HG23 ' HG2' ' A' ' 570' ' ' GLU . 80.3 p -96.8 29.24 3.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.883 0.373 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -136.73 -40.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.051 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.4 m -110.64 -12.46 14.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.17 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 78.49 5.73 87.97 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.469 -0.872 . . . . 0.0 112.739 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.646 HG12 ' HB3' ' A' ' 597' ' ' CYS . 11.7 p -65.87 145.81 13.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.577 0.227 . . . . 0.0 110.981 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.477 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.3 mttm -127.18 139.13 53.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.949 0.404 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.58 177.94 9.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.205 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.401 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 44.8 m80 -73.6 175.31 7.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.243 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.98 -37.36 87.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.672 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.43 -32.79 16.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.43 ' HA ' HD12 ' A' ' 611' ' ' LEU . 5.4 m -65.13 -19.35 65.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.472 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -53.5 -32.61 51.06 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.951 0.405 . . . . 0.0 110.65 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -93.61 -37.18 12.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.516 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 608' ' ' CYS . 12.7 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.095 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.539 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 6.8 t-20 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.107 0.48 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.703 ' CE1' HG13 ' A' ' 602' ' ' VAL . 31.5 m-85 -61.44 124.24 20.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.368 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.4 ' HG3' ' CG2' ' A' ' 598' ' ' THR . 7.0 mm-40 -122.9 154.63 38.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.235 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 28.3 t -62.41 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.011 0.434 . . . . 0.0 110.925 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.799 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.6 OUTLIER -124.34 131.62 53.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.458 179.854 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 32.2 m -99.55 116.78 32.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.002 0.43 . . . . 0.0 110.678 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.799 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.32 119.05 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.205 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 19.6 p -76.04 -26.27 56.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 0.0 110.072 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 p -135.4 160.47 67.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.93 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.816 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.1 Cg_exo -45.51 111.61 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.321 2.014 . . . . 0.0 112.512 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.7 m -129.31 128.36 43.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -78.41 156.06 29.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.538 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.8 t -88.56 119.98 29.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.444 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -58.37 -18.73 29.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.332 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -80.81 -57.75 3.41 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.7 p -115.83 15.89 16.31 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 580' ' ' CYS . 43.8 mt-10 46.06 48.0 12.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 111.232 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.89 124.64 5.83 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.995 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.0 tp -46.26 133.35 9.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.362 . . . . 0.0 111.249 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.638 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.34 39.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.858 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.469 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.961 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.469 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 6.8 ptt180 . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.689 0.281 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 22.1 tt0 -44.98 154.29 0.15 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.465 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.02 -165.41 24.37 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.758 -0.735 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.448 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.7 mmm -127.43 143.82 51.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.414 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 10.8 ttt180 -146.54 140.49 26.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.028 0.442 . . . . 0.0 111.44 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.557 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.7 t -77.12 141.59 40.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.352 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.4 ' CG2' ' HG3' ' A' ' 570' ' ' GLU . 73.2 p -97.75 30.56 2.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.98 0.419 . . . . 0.0 110.787 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -138.33 -40.03 0.52 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.097 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.5 m -113.15 -21.13 11.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.064 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.11 0.01 78.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.625 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.703 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.1 p -58.57 126.6 16.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.966 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.6 OUTLIER -112.09 139.37 47.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.59 177.84 9.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.006 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -73.64 174.03 8.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.254 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.09 -36.93 85.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.542 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.54 -38.7 13.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 111.368 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.412 ' HA ' HD12 ' A' ' 611' ' ' LEU . 8.5 m -59.53 -20.1 53.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.55 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -55.95 -39.52 71.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.949 0.404 . . . . 0.0 110.683 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -82.51 -34.72 27.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.491 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 608' ' ' CYS . 17.8 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.973 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.586 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.4 t30 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 121.179 0.514 . . . . 0.0 110.059 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.69 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.6 m-85 -64.7 122.18 16.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.628 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.543 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -122.54 150.93 41.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.322 179.507 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.4 105.53 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.971 0.415 . . . . 0.0 111.251 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.487 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.37 132.4 53.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.272 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -94.79 121.79 36.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.005 0.431 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.487 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.23 109.42 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 33.6 p -69.11 -27.9 65.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.06 0.457 . . . . 0.0 109.933 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.424 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.8 p -135.98 162.14 58.47 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.851 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.664 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.0 Cg_endo -47.65 110.47 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.44 2.094 . . . . 0.0 112.043 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.724 ' O ' HD12 ' A' ' 587' ' ' LEU . 97.7 m -124.91 131.26 53.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -81.29 156.11 25.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.029 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -86.86 122.76 31.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.794 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.57 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -61.98 -14.6 36.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.372 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -87.99 -57.68 2.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.912 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.6 p -113.22 14.15 19.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.8 mm-40 46.81 48.57 14.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 0.0 111.22 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.45 123.55 5.53 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.967 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.664 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.3 tp -46.24 134.39 8.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.866 0.365 . . . . 0.0 111.397 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.724 HD12 ' O ' ' A' ' 578' ' ' THR . 1.2 mp -93.66 40.0 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.468 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.846 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.468 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt-85 . . . . . 0 CA--C 1.529 0.165 0 CA-C-O 120.677 0.275 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 9.7 tt0 -42.41 153.6 0.07 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.711 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.42 -170.21 31.96 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.527 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.5 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.5 mmm -123.07 143.7 49.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.419 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 3.8 ttt-85 -144.76 140.96 28.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.019 0.438 . . . . 0.0 111.167 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.586 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 52.8 t -76.06 144.34 40.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.482 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.543 HG22 ' HG2' ' A' ' 570' ' ' GLU . 12.9 p -98.82 30.79 3.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -140.78 -40.69 0.41 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.027 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.63 -20.14 11.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.166 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.27 4.39 83.82 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.626 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.69 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.4 p -61.47 120.88 8.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.825 0.345 . . . . 0.0 110.837 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -105.35 138.47 41.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 111.065 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.72 177.83 9.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.806 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.406 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 47.2 m80 -73.56 -176.85 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.111 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.88 -37.04 67.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.655 0.264 . . . . 0.0 111.366 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -32.53 16.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.891 0.377 . . . . 0.0 111.262 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 611' ' ' LEU . 54.3 m -71.19 -24.79 62.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.339 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -28.01 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.96 -34.54 13.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.558 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.9 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.007 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.502 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 30.1 t30 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.028 0.442 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.709 ' CE1' HG13 ' A' ' 602' ' ' VAL . 38.3 m-85 -61.35 113.44 2.64 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.195 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.478 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.5 OUTLIER -114.21 156.86 23.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.151 179.489 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.43 105.29 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.974 0.416 . . . . 0.0 110.938 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.905 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -121.99 133.9 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.378 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.82 HG22 ' HD3' ' A' ' 592' ' ' ARG . 6.2 m -98.72 117.52 33.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.683 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.905 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.15 114.02 5.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.176 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 56.1 p -72.97 -25.33 60.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.01 0.433 . . . . 0.0 110.169 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.7 p -134.18 159.85 70.76 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.144 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.797 ' HB3' HD11 ' A' ' 586' ' ' LEU . 89.1 Cg_exo -46.35 112.38 0.46 Allowed 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.439 2.093 . . . . 0.0 112.44 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.734 ' O ' HD12 ' A' ' 587' ' ' LEU . 42.9 m -128.35 134.18 48.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.822 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 579' ' ' TYR . . . . . 0.444 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -86.11 156.22 20.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.311 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.479 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.9 t -84.99 123.56 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.121 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.666 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -61.19 -15.39 33.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.365 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -88.08 -57.67 2.85 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.0 p -112.45 13.33 20.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 580' ' ' CYS . 76.1 mm-40 47.1 50.06 14.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.772 0.32 . . . . 0.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.78 124.38 5.66 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.034 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.797 HD11 ' HB3' ' A' ' 577' ' ' PRO . 17.1 tp -46.3 135.02 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.329 . . . . 0.0 111.292 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -94.67 39.12 1.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.496 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.77 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.82 ' HD3' HG22 ' A' ' 573' ' ' THR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.642 0.258 . . . . 0.0 111.19 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.4 OUTLIER -40.63 159.98 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.892 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -173.1 -170.0 36.23 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.589 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 68.4 mmm -122.15 143.91 49.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt180 -146.73 142.01 27.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.913 0.387 . . . . 0.0 111.504 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.641 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.4 t -78.28 142.59 37.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.166 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.485 HG23 ' O ' ' A' ' 568' ' ' ASN . 2.6 p -98.16 30.5 3.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.916 0.388 . . . . 0.0 110.785 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -138.32 -40.26 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.217 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.8 m -111.54 -20.25 12.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.74 -4.19 81.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.615 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.709 HG13 ' CE1' ' A' ' 569' ' ' PHE . 13.7 p -54.5 145.15 4.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.608 0.242 . . . . 0.0 110.922 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.475 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.7 141.89 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.927 0.394 . . . . 0.0 110.767 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.36 178.07 8.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.046 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -76.82 178.7 6.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.27 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -66.84 -36.64 82.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.645 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -34.61 15.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.408 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.9 m -64.38 -21.82 66.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.502 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -56.3 -37.24 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 110.655 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -35.54 27.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.458 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 36.5 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 179.889 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.538 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.3 t30 . . . . . 0 C--O 1.233 0.195 0 CA-C-O 121.084 0.469 . . . . 0.0 110.028 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.485 ' CE1' HG13 ' A' ' 602' ' ' VAL . 38.6 m-85 -61.29 115.95 4.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.392 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.67 154.76 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.108 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.36 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.938 0.399 . . . . 0.0 111.265 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.751 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 1.2 t90 -122.64 129.2 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.408 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.538 HG23 ' HA ' ' A' ' 593' ' ' GLN . 19.7 m -97.87 116.95 31.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.688 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.751 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.42 119.13 9.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.165 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 29.0 p -77.15 -26.88 53.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.106 0.479 . . . . 0.0 110.118 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 17.6 p -134.44 160.8 67.09 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.944 179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.807 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.3 Cg_exo -45.36 111.09 0.29 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.399 2.066 . . . . 0.0 112.402 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 587' ' ' LEU . 56.2 m -129.83 125.01 34.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.977 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -75.28 156.04 36.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.251 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' A' ' 584' ' ' GLU . 52.3 t -86.65 120.26 27.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.807 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -57.96 -18.65 24.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.357 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -83.12 -57.74 3.15 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.08 15.04 18.4 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mp0 46.32 47.77 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 111.26 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.33 125.24 6.09 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.859 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.6 tp -46.21 133.6 9.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.872 0.368 . . . . 0.0 111.266 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.06 38.62 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.925 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.5 ptp180 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.711 0.291 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.538 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.2 tt0 -45.23 154.02 0.18 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.389 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.48 -170.37 31.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.693 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.422 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 59.7 mmm -124.38 144.69 49.89 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.5 ttt180 -146.62 142.0 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.924 0.393 . . . . 0.0 111.201 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.608 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.3 t -76.43 142.99 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.388 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 568' ' ' ASN . 18.7 p -98.83 31.39 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.965 0.412 . . . . 0.0 110.684 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -139.75 -39.72 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.114 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.1 m -111.14 -20.79 12.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.179 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 91.01 -5.12 81.85 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.596 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.619 HG23 ' CG ' ' A' ' 581' ' ' TYR . 11.6 p -54.42 142.44 8.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.602 0.239 . . . . 0.0 111.04 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.2 OUTLIER -127.02 140.45 52.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -148.61 177.9 9.09 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.45 ' HA ' HD21 ' A' ' 587' ' ' LEU . 50.4 m80 -72.82 176.03 5.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.269 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -64.38 -35.63 81.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.496 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -43.25 10.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.425 . . . . 0.0 111.222 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.814 ' HA ' HD12 ' A' ' 611' ' ' LEU . 20.1 m -55.27 -22.32 17.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.623 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -54.01 -39.46 66.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.925 0.393 . . . . 0.0 110.74 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -32.51 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.439 179.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.7 mt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.016 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.554 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.053 0.454 . . . . 0.0 110.103 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.688 ' HE1' HG13 ' A' ' 602' ' ' VAL . 24.9 m-85 -66.23 122.73 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.484 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.617 ' OE1' HG21 ' A' ' 598' ' ' THR . 18.3 mt-10 -122.19 155.42 35.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.4 105.33 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.957 0.408 . . . . 0.0 111.17 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.93 129.29 51.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.295 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.7 m -96.06 117.14 30.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 0.0 110.693 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.12 110.66 2.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.056 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.1 p -69.5 -24.21 63.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.199 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.2 p -137.36 160.01 67.2 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.039 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.754 ' HB3' HD11 ' A' ' 586' ' ' LEU . 87.5 Cg_exo -46.18 111.9 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.401 2.067 . . . . 0.0 112.473 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 73.3 m -129.6 135.85 49.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.917 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -85.02 156.11 21.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.404 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.51 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.5 t -86.8 122.01 30.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.592 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -60.3 -16.51 35.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.427 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -83.98 -57.6 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 20.4 p -115.44 14.94 16.79 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 580' ' ' CYS . 6.1 mt-10 46.46 51.8 11.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.331 . . . . 0.0 111.165 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.55 123.83 5.22 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.956 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.754 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.5 tp -46.29 133.79 9.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 111.253 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.98 39.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.001 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.466 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.466 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt85 . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.732 0.301 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 4.4 tt0 -45.0 155.63 0.11 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.425 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.31 -167.88 26.6 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.626 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.427 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.4 mmm -126.24 143.24 51.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 7.3 ttt180 -146.69 141.43 26.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.383 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.574 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.8 t -77.15 143.16 39.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.617 HG21 ' OE1' ' A' ' 570' ' ' GLU . 28.5 p -98.46 30.61 3.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.877 0.37 . . . . 0.0 110.724 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -139.14 -40.37 0.47 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.121 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.7 m -110.37 -17.67 13.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.67 -5.0 85.77 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.67 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' HE1' ' A' ' 569' ' ' PHE . 12.4 p -54.5 142.86 7.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 O-C-N 122.734 -0.274 . . . . 0.0 111.023 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.7 mttp -126.53 140.44 52.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.857 0.361 . . . . 0.0 110.801 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.56 177.97 9.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.05 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -75.31 176.82 7.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.08 -41.85 94.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.514 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -38.76 13.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.035 0.445 . . . . 0.0 111.142 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 88.4 m -59.03 -20.52 53.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.12 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.02 -42.0 75.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.994 0.426 . . . . 0.0 110.385 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.6 -33.93 58.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.138 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 56.4 mt . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.978 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.561 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.8 t30 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 121.092 0.472 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.631 ' CE1' HG13 ' A' ' 602' ' ' VAL . 36.7 m-85 -61.35 114.88 3.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.323 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 598' ' ' THR . 2.7 pp20? -113.7 153.7 28.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.077 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.3 105.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 111.071 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.42 130.81 53.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.272 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -93.39 119.61 32.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.412 . . . . 0.0 110.913 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.488 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.31 109.49 1.92 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.261 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.2 p -72.12 -27.86 62.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.022 0.439 . . . . 0.0 109.982 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.44 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.7 p -133.4 162.23 58.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.911 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.528 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.5 110.45 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.413 2.075 . . . . 0.0 112.053 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.78 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.7 m -125.68 130.97 52.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.192 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 579' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 586' ' ' LEU . 28.4 m-85 -84.25 156.12 22.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.925 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.4 t -85.44 123.13 30.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.912 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -62.96 -14.09 42.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -88.99 -57.66 2.82 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.37 13.16 20.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 13.5 mt-10 47.42 51.35 13.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.27 122.81 4.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.951 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.528 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.25 134.36 8.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 111.288 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.78 HD12 ' O ' ' A' ' 578' ' ' THR . 1.3 mp -94.12 38.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.81 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.669 0.271 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.526 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 1.1 tt0 -43.14 154.48 0.07 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.682 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.76 -163.71 22.15 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.689 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.408 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.6 mmm -129.44 144.56 51.3 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 22.5 ttt-85 -146.65 140.48 26.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.974 0.416 . . . . 0.0 111.308 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.5 t -75.67 142.77 42.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.397 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 570' ' ' GLU . 19.4 p -98.49 30.97 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.654 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -139.37 -40.01 0.47 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.239 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.16 -20.58 12.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.56 -5.18 82.51 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.684 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.669 HG23 ' CG ' ' A' ' 581' ' ' TYR . 12.0 p -54.36 145.67 4.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 CA-C-N 116.744 0.272 . . . . 0.0 110.954 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.48 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.73 141.13 51.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.895 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.6 p -148.42 178.06 8.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.125 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -74.97 175.76 7.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.354 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -63.63 -37.7 88.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.593 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 607' ' ' LYS . . . . . 0.601 ' HG2' HD11 ' A' ' 611' ' ' LEU . 8.3 tttt -90.47 -40.3 12.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.952 0.406 . . . . 0.0 111.184 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.816 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.4 m -58.24 -19.87 37.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.398 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -54.97 -33.69 62.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.965 0.412 . . . . 0.0 110.606 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -90.44 -33.8 15.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.38 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.7 mt . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.04 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.589 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.7 t-20 . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 121.113 0.482 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.688 ' CE1' HG13 ' A' ' 602' ' ' VAL . 28.9 m-85 -66.47 115.77 6.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.292 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -114.23 155.09 26.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.113 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 33.4 t -62.37 105.21 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.952 0.406 . . . . 0.0 111.044 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.538 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.14 132.59 54.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.18 119.24 34.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.943 0.401 . . . . 0.0 110.857 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.538 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -66.08 109.48 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.094 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 1.9 p -70.78 -30.25 66.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.114 0.483 . . . . 0.0 110.017 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 1.4 p -131.64 162.98 52.93 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.952 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.602 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.1 110.54 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.465 2.11 . . . . 0.0 112.146 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.801 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.9 m -125.48 134.29 52.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -85.08 156.06 21.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.852 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.53 ' O ' ' N ' ' A' ' 584' ' ' GLU . 51.4 t -87.9 120.53 29.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.991 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.629 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -58.87 -18.08 29.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.351 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -83.02 -57.7 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.1 p -114.98 14.28 17.14 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.4 mt-10 46.97 51.45 12.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.58 123.49 5.11 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.938 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.602 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.26 131.59 10.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.85 0.357 . . . . 0.0 111.207 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.801 HD12 ' O ' ' A' ' 578' ' ' THR . 1.9 mp -93.48 42.72 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 588' ' ' TRP . 3.0 ptt180 . . . . . 0 CA--C 1.529 0.167 0 CA-C-O 120.778 0.323 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.1 tt0 -45.02 152.6 0.23 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.695 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.71 -158.92 10.68 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.423 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 63.9 mmm -131.32 144.66 51.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.46 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.0 ttt-85 -146.51 140.7 26.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.961 0.41 . . . . 0.0 111.316 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.647 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.8 t -76.72 142.22 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 29.8 p -97.85 30.52 2.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.954 0.406 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -137.72 -40.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.013 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -111.86 -16.94 13.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.133 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.8 -3.91 86.66 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.689 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' CE1' ' A' ' 569' ' ' PHE . 11.4 p -54.58 145.36 4.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.555 0.217 . . . . 0.0 111.01 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.57 140.51 51.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.94 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.8 p -148.59 178.0 9.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.569 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -75.04 174.9 8.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.394 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -63.52 -38.17 90.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.608 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -34.49 15.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.922 0.391 . . . . 0.0 111.328 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.686 ' HA ' HD12 ' A' ' 611' ' ' LEU . 7.9 m -62.67 -19.2 63.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.251 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -54.8 -34.14 62.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.982 0.42 . . . . 0.0 110.633 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.07 -35.69 15.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.396 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.5 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.56 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.9 t30 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.034 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.729 ' HE1' HG13 ' A' ' 602' ' ' VAL . 26.0 m-85 -62.13 121.77 13.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.583 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.489 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -120.64 152.87 37.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.167 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.37 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.976 0.417 . . . . 0.0 111.25 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.496 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.11 130.01 52.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.299 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.1 m -91.98 119.97 32.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.857 0.36 . . . . 0.0 110.844 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.496 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.37 109.35 1.57 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.127 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 11.5 p -70.45 -26.05 63.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.118 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.423 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 13.9 p -139.4 161.05 59.28 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.81 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.773 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.3 Cg_exo -44.35 111.14 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.339 2.026 . . . . 0.0 112.418 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.84 ' O ' HD12 ' A' ' 587' ' ' LEU . 87.5 m -125.72 135.33 51.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 579' ' ' TYR . . . . . 0.405 ' CE1' HD13 ' A' ' 586' ' ' LEU . 25.9 m-85 -88.41 156.03 19.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.159 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.3 t -85.26 126.06 33.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -65.85 -11.41 46.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 179.802 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -91.53 -57.65 2.69 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.47 10.12 19.68 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mm-40 50.13 50.36 18.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.52 120.64 4.37 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.971 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.773 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.4 tp -46.26 131.58 10.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.874 0.369 . . . . 0.0 111.415 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -93.03 44.8 1.16 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.591 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.832 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.669 0.271 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.547 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 10.2 tt0 -41.23 153.36 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.808 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.65 -171.53 33.74 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.551 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 64.4 mmm -122.05 144.72 48.74 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.432 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt-85 -146.45 140.02 25.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 111.277 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.56 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 52.3 t -76.23 142.34 41.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.454 179.347 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.489 HG22 ' HG2' ' A' ' 570' ' ' GLU . 14.9 p -97.18 29.96 2.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.944 0.402 . . . . 0.0 110.699 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -137.98 -42.01 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.024 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.4 m -111.74 -18.4 12.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.135 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.19 -2.83 86.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.729 HG13 ' HE1' ' A' ' 569' ' ' PHE . 9.6 p -55.78 132.59 19.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 110.958 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.7 OUTLIER -115.71 140.38 49.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.989 0.423 . . . . 0.0 110.936 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.62 178.12 8.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.088 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.613 ' CD2' HD23 ' A' ' 587' ' ' LEU . 36.6 m80 -75.63 176.57 7.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.32 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.21 -37.66 88.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.626 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.48 -41.52 11.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.951 0.405 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.593 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.2 m -56.96 -21.01 26.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -53.21 -35.98 60.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.832 0.349 . . . . 0.0 110.796 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.47 -35.42 15.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.552 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.7 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.544 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 121.102 0.477 . . . . 0.0 110.041 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.495 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 30.8 m-85 -61.42 120.83 11.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.61 150.72 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.31 105.39 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.88 0.371 . . . . 0.0 111.049 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.776 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.52 129.34 51.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.48 179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.5 m -95.83 117.38 30.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.907 0.384 . . . . 0.0 110.606 179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.776 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.48 111.07 2.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.244 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 22.3 p -69.8 -24.09 63.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.001 0.429 . . . . 0.0 110.238 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 34.9 p -136.87 159.43 70.19 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.765 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.2 Cg_exo -46.02 112.11 0.41 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.48 2.12 . . . . 0.0 112.433 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.74 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.0 m -129.2 135.45 48.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -84.75 156.04 21.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.229 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.0 t -86.73 121.4 29.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.637 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -59.98 -17.07 35.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.234 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.85 -57.74 2.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.18 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.8 p -112.99 13.38 19.48 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.2 mt-10 46.77 49.62 14.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 111.169 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.19 124.73 5.57 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.938 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.3 tp -46.2 134.47 8.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.298 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 578' ' ' THR . 2.6 mp -94.11 39.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.696 0.284 . . . . 0.0 111.137 . . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.506 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.1 OUTLIER -45.22 153.38 0.21 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 -179.942 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.14 -172.54 31.74 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.495 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 71.9 mmm -121.18 144.58 48.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.65 0.262 . . . . 0.0 110.314 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.1 ttt180 -146.68 141.21 26.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 111.197 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.544 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 52.6 t -76.83 144.31 39.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.478 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.6 p -98.96 30.85 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.955 0.407 . . . . 0.0 110.756 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -140.89 -40.37 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.178 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.49 -18.44 13.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.08 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.71 -5.67 84.35 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.632 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.637 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.4 p -54.69 142.63 8.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.61 0.243 . . . . 0.0 111.073 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.478 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.1 mttm -125.68 140.79 52.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.799 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -148.71 177.92 9.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.402 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 49.4 m80 -75.37 174.38 9.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.217 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 606' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -65.02 -32.91 74.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 607' ' ' LYS . . . . . 0.519 ' HG2' HD11 ' A' ' 611' ' ' LEU . 33.3 tttm -90.7 -43.85 9.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.046 0.451 . . . . 0.0 111.076 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.839 ' HA ' HD12 ' A' ' 611' ' ' LEU . 50.9 m -60.34 -24.77 65.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.429 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 609' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -57.18 -28.4 62.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.352 . . . . 0.0 110.675 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -91.08 -31.35 16.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.448 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.839 HD12 ' HA ' ' A' ' 608' ' ' CYS . 3.4 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.552 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 5.0 t30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.074 0.464 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.647 ' HE1' HG13 ' A' ' 602' ' ' VAL . 31.1 m-85 -61.48 124.53 20.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.492 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -124.12 154.01 40.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.208 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 27.9 t -62.4 105.46 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.948 0.404 . . . . 0.0 111.149 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.2 OUTLIER -122.95 134.34 54.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.313 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.5 121.18 38.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.381 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.3 109.41 2.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.131 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 5.3 p -71.05 -25.83 62.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.092 0.472 . . . . 0.0 109.995 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.429 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 6.5 p -136.42 161.09 64.11 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.782 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.575 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.71 110.48 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.504 2.136 . . . . 0.0 112.05 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.809 ' O ' HD12 ' A' ' 587' ' ' LEU . 94.8 m -124.77 136.8 54.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.182 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -86.8 156.14 20.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.523 ' O ' ' N ' ' A' ' 584' ' ' GLU . 53.2 t -89.44 119.65 30.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.57 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -59.36 -18.2 36.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.388 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.32 -57.86 3.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.131 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 31.8 p -113.48 13.57 18.89 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.1 OUTLIER 46.9 51.57 12.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.808 0.337 . . . . 0.0 111.092 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.98 123.13 4.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.952 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.575 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.14 133.81 8.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.319 . . . . 0.0 111.445 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 578' ' ' THR . 2.8 mp -94.27 43.03 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.662 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.471 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.863 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.471 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 2.8 ptt85 . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.673 0.273 . . . . 0.0 111.222 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 16.8 tt0 -41.35 155.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.779 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.31 -170.14 35.06 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.584 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.435 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.9 mmm -122.28 145.99 47.71 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.429 -0.211 . . . . 0.0 110.429 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.5 ttt180 -146.53 141.87 27.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.6 t -79.12 140.41 37.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.201 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 69.7 p -97.27 30.92 2.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.005 0.431 . . . . 0.0 110.54 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -136.95 -40.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.22 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.1 m -112.37 -22.24 10.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.272 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 94.08 -5.47 72.0 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.734 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.647 HG13 ' HE1' ' A' ' 569' ' ' PHE . 11.4 p -54.5 144.55 5.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.685 0.278 . . . . 0.0 110.958 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.484 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.9 mttp -127.65 140.13 52.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.899 0.381 . . . . 0.0 110.727 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.47 177.97 9.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.023 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.479 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.2 m80 -75.06 -177.06 3.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.233 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 606' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 2.9 tt0 -73.46 -35.66 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.464 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -34.73 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.581 ' HA ' HD12 ' A' ' 611' ' ' LEU . 27.6 m -67.57 -23.8 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.372 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 609' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -59.39 -28.51 66.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.886 0.374 . . . . 0.0 110.622 179.733 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -88.79 -33.43 17.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.328 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 608' ' ' CYS . 5.9 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.088 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.503 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 11.6 t30 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 121.127 0.489 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.476 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.8 m-85 -61.99 116.76 5.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.5 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 570' ' ' GLU . . . . . 0.506 ' CD ' HG21 ' A' ' 598' ' ' THR . 45.6 mt-10 -116.96 151.39 36.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.279 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 30.1 t -62.49 105.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 111.087 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.551 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -124.44 130.21 52.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.365 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -94.52 119.04 32.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.764 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.551 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -62.93 110.42 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.117 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 9.7 p -71.94 -26.25 62.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.092 0.472 . . . . 0.0 109.965 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 43.3 p -136.03 159.46 70.97 Favored Pre-proline 0 N--CA 1.454 -0.243 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.967 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.687 ' HB3' HD11 ' A' ' 586' ' ' LEU . 84.2 Cg_exo -45.38 111.39 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.45 2.1 . . . . 0.0 112.497 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.82 ' O ' HD12 ' A' ' 587' ' ' LEU . 92.7 m -127.28 138.39 53.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.06 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -89.01 156.09 19.08 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.061 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.496 ' O ' ' N ' ' A' ' 584' ' ' GLU . 43.2 t -88.25 122.33 31.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.611 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -61.54 -16.39 47.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.269 179.717 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -84.17 -57.62 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.3 p -116.04 16.03 16.09 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.9 mp0 45.84 52.21 9.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 111.247 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.36 122.86 4.76 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.071 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.687 HD11 ' HB3' ' A' ' 577' ' ' PRO . 16.4 tp -46.35 135.92 7.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.267 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.82 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -95.43 39.88 1.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.779 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.757 0.313 . . . . 0.0 111.191 . . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' HG23 ' A' ' 573' ' ' THR . 3.2 tt0 -42.99 153.82 0.08 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.592 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.96 -168.67 29.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.796 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.7 mmm -125.79 144.1 50.78 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 9.5 ttt180 -146.66 141.09 26.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.036 0.446 . . . . 0.0 111.57 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.52 ' HB3' HG12 ' A' ' 602' ' ' VAL . 42.5 t -79.0 144.24 34.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.228 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 598' ' ' THR . . . . . 0.506 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.8 p -99.61 32.15 2.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 0.0 110.569 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -139.25 -41.2 0.46 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.155 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.68 -17.36 13.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.49 -6.02 83.22 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.657 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.611 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.3 p -54.53 142.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.757 0.313 . . . . 0.0 111.068 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -126.12 141.45 51.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.666 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.1 p -148.32 178.05 8.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.433 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -76.65 177.36 7.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.184 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.1 -59.32 5.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.576 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -36.48 64.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 0.0 111.597 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.8 m -57.77 -21.46 41.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.48 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -55.32 -35.43 65.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.9 0.381 . . . . 0.0 110.801 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 -35.46 18.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.72 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.057 179.88 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 568' ' ' ASN . . . . . 0.55 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 4.9 t30 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 121.178 0.513 . . . . 0.0 109.915 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 569' ' ' PHE . . . . . 0.56 ' HE1' HG13 ' A' ' 602' ' ' VAL . 23.1 m-85 -61.48 125.74 24.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.675 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -128.39 153.81 46.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.219 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.38 105.41 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 0.0 111.147 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 572' ' ' TRP . . . . . 0.874 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -123.6 132.93 53.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.374 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 573' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.2 m -99.75 117.36 33.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.648 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 574' ' ' ALA . . . . . 0.874 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.82 118.25 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.319 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.5 p -77.06 -26.51 53.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.168 0.509 . . . . 0.0 110.053 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 576' ' ' THR . . . . . 0.452 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 64.1 p -131.95 157.93 76.88 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.912 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 577' ' ' PRO . . . . . 0.587 ' CB ' HD11 ' A' ' 586' ' ' LEU . 2.6 Cg_endo -45.85 111.37 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.666 2.244 . . . . 0.0 112.193 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 578' ' ' THR . . . . . 0.628 ' O ' HD12 ' A' ' 587' ' ' LEU . 33.9 m -127.61 131.91 49.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -82.99 156.09 23.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.151 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 580' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -85.68 122.12 29.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 581' ' ' TYR . . . . . 0.572 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.43 -13.96 35.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.395 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.09 -57.64 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.4 4.94 24.93 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 584' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.8 OUTLIER 53.93 48.94 20.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.57 126.09 5.6 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.949 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 586' ' ' LEU . . . . . 0.587 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.0 tp -46.31 134.42 8.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 111.234 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 587' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.53 39.62 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.802 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.1 ptt180 . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.751 0.31 . . . . 0.0 111.306 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 593' ' ' GLN . . . . . 0.478 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 12.0 tt0 -45.62 154.76 0.19 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.397 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.45 -163.62 21.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.699 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 595' ' ' MET . . . . . 0.462 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 69.3 mmm -126.79 144.99 50.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.353 -0.239 . . . . 0.0 110.353 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 0.2 OUTLIER -145.63 141.78 28.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.974 0.416 . . . . 0.0 111.228 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 597' ' ' CYS . . . . . 0.575 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.5 t -78.92 142.21 36.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.237 179.253 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.9 p -98.38 31.32 2.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.992 0.425 . . . . 0.0 110.564 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -139.42 -40.76 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.224 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.0 m -112.41 -21.21 11.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.253 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 92.41 -4.6 76.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.623 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 602' ' ' VAL . . . . . 0.575 HG12 ' HB3' ' A' ' 597' ' ' CYS . 8.0 p -54.41 140.84 11.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.632 0.253 . . . . 0.0 110.876 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 603' ' ' LYS . . . . . 0.455 ' HD2' ' CE2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -124.88 139.82 53.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.856 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -148.71 177.88 9.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.066 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 605' ' ' HIS . . . . . 0.578 ' CD2' HD23 ' A' ' 587' ' ' LEU . 54.3 m80 -75.86 177.73 6.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.283 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 606' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.8 tt0 -67.48 -35.23 78.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.285 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -90.85 -47.32 7.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 608' ' ' CYS . . . . . 0.528 ' HA ' HD12 ' A' ' 611' ' ' LEU . 91.0 m -59.44 -22.35 61.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.497 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 609' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.3 OUTLIER -57.8 -31.09 66.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.866 0.365 . . . . 0.0 110.434 179.746 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.28 -30.46 18.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.393 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 611' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 608' ' ' CYS . 13.9 mt . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.133 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.719 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 16.1 tt0 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.815 0.34 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.467 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 94.8 m-70 -65.36 130.74 44.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.96 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -77.68 61.96 2.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.132 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.727 ' CE1' HG13 ' A' ' 602' ' ' VAL . 32.7 m-85 -61.45 117.58 5.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.399 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.558 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -114.57 155.89 25.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.15 179.354 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.33 105.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.931 0.396 . . . . 0.0 111.148 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -121.64 132.44 54.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.317 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.538 HG22 ' CD ' ' A' ' 592' ' ' ARG . 7.4 m -97.23 120.63 37.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.48 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.36 109.31 2.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.136 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 24.5 p -72.0 -25.6 61.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.443 . . . . 0.0 110.073 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 22.6 p -136.42 159.68 69.72 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.87 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.509 ' CB ' HD11 ' A' ' 586' ' ' LEU . 1.8 Cg_endo -45.28 110.5 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.555 2.17 . . . . 0.0 112.08 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.805 ' O ' HD12 ' A' ' 587' ' ' LEU . 72.1 m -127.45 137.34 52.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.052 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 579' ' ' TYR . . . . . 0.441 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -89.49 156.22 18.78 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.126 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -84.41 126.01 32.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.982 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.705 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.95 -13.31 56.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.136 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -57.62 2.87 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.827 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.2 p -114.87 13.52 17.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 580' ' ' CYS . 12.5 mm-40 47.96 51.26 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.7 123.52 5.26 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.027 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.509 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.0 tp -46.29 134.34 8.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.816 0.341 . . . . 0.0 111.23 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.805 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -95.04 40.74 1.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.941 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' HB2' ' CD2' ' A' ' 586' ' ' LEU . 0.0 OUTLIER -108.44 -165.06 1.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.781 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.41 -76.15 0.22 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.51 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 56.9 mt -131.42 -61.49 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.775 0.321 . . . . 0.0 111.064 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.24 90.39 4.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.222 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.538 ' CD ' HG22 ' A' ' 573' ' ' THR . 0.0 OUTLIER -54.66 -21.31 10.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.17 179.658 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.537 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 13.4 tt0 -42.46 158.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.663 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.44 -166.97 31.02 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.561 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 62.3 mmm -127.38 143.61 51.19 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 5.8 ttt180 -146.62 141.13 26.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.979 0.419 . . . . 0.0 111.476 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.592 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.0 t -76.85 143.1 39.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.276 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 570' ' ' GLU . 3.1 p -98.38 30.75 3.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.941 0.401 . . . . 0.0 110.765 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -139.51 -39.44 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.31 -18.89 12.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.241 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.58 -5.06 85.06 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.614 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.727 HG13 ' CE1' ' A' ' 569' ' ' PHE . 10.3 p -54.44 144.25 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.635 0.218 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.34 141.34 51.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.861 0.363 . . . . 0.0 110.981 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 604' ' ' CYS . . . . . 0.41 ' HB3' HD12 ' A' ' 612' ' ' LEU . 1.7 p -148.55 178.08 8.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.417 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.1 m80 -75.59 177.13 7.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.264 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.62 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.51 -36.31 14.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.932 0.396 . . . . 0.0 111.384 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.787 ' HA ' HD12 ' A' ' 611' ' ' LEU . 18.0 m -61.55 -19.9 62.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.359 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.13 -34.07 65.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.0 -33.77 18.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.787 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.4 mt -71.28 -30.85 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.062 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.607 HD13 ' CZ ' ' A' ' 569' ' ' PHE . 0.7 OUTLIER -58.14 152.06 17.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.048 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.54 ' N ' HD23 ' A' ' 612' ' ' LEU . 1.1 t-20 -78.23 143.16 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.777 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.719 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -100.27 149.72 23.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -176.48 39.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.608 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.836 0.35 . . . . 0.0 111.23 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 96.2 m-70 -64.68 131.32 46.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.014 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 568' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 598' ' ' THR . 0.5 OUTLIER -75.54 64.61 1.66 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.169 0.509 . . . . 0.0 109.944 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.501 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 27.4 m-85 -61.39 117.58 5.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.639 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.498 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -118.74 150.83 39.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.099 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.52 105.39 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.974 0.416 . . . . 0.0 111.148 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.547 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.3 OUTLIER -122.44 126.81 48.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.225 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.1 m -91.38 118.09 30.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.995 0.426 . . . . 0.0 110.823 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.547 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.9 109.45 1.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.7 p -70.19 -28.74 65.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.128 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.1 p -132.94 162.52 57.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.971 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.589 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.6 Cg_endo -48.21 110.48 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.508 2.139 . . . . 0.0 111.998 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.785 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.1 m -126.33 134.19 51.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.05 156.07 21.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.121 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.49 ' O ' ' N ' ' A' ' 584' ' ' GLU . 45.2 t -86.84 123.1 31.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.843 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.646 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.22 -15.52 47.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.29 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 582' ' ' GLU . . . . . 0.559 ' HB2' HD12 ' A' ' 612' ' ' LEU . 14.7 tm-20 -85.54 -57.6 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.2 p -114.67 14.23 17.53 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.49 ' N ' ' O ' ' A' ' 580' ' ' CYS . 3.6 mt-10 47.22 51.74 12.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.122 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.4 123.04 4.99 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.051 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.589 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.22 134.15 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 0.0 111.242 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.785 HD12 ' O ' ' A' ' 578' ' ' THR . 1.7 mp -94.01 39.51 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.36 -168.58 1.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 112.72 -79.28 0.26 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.525 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 12.9 mt -127.23 -62.07 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 0.0 111.114 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.05 90.19 4.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.6 ptt180 -53.88 -21.73 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.237 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.555 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 7.1 tt0 -42.75 152.4 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.682 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.16 -172.71 32.94 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.572 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.501 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.08 145.98 47.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.556 0.217 . . . . 0.0 110.427 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 6.9 ttt180 -146.68 141.49 26.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.401 . . . . 0.0 111.223 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.55 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.0 t -77.71 144.12 37.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.505 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.498 HG22 ' HG2' ' A' ' 570' ' ' GLU . 16.4 p -99.18 31.3 3.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.935 0.398 . . . . 0.0 110.688 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -140.37 -40.77 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.217 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.5 m -110.44 -18.81 13.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.127 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.99 -5.22 85.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.573 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.646 HG23 ' CG ' ' A' ' 581' ' ' TYR . 15.0 p -54.57 143.93 6.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.648 0.261 . . . . 0.0 111.029 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.459 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -126.18 140.31 52.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.726 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -148.59 178.09 8.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.1 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 47.3 m80 -74.89 -176.89 3.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.285 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 606' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.2 tm-20 -72.61 -36.08 68.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.786 0.327 . . . . 0.0 111.315 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -90.68 -46.24 8.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.723 ' HA ' HD12 ' A' ' 611' ' ' LEU . 56.3 m -58.12 -24.79 60.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.356 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 609' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.2 OUTLIER -57.92 -30.61 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 110.53 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -86.61 -31.29 21.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.304 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.0 mt -74.41 -32.11 62.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.004 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' ' 582' ' ' GLU . 0.8 OUTLIER -55.28 142.36 32.05 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.998 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.3 157.43 33.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.608 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -108.41 141.67 39.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.1 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -161.06 41.76 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.536 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.687 0.28 . . . . 0.0 111.142 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.0 m-70 -68.72 131.22 44.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -79.31 63.46 3.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.196 0.522 . . . . 0.0 109.924 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.715 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.4 m-85 -61.12 121.86 13.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.466 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.532 ' CD ' HG21 ' A' ' 598' ' ' THR . 63.5 mt-10 -121.4 153.74 37.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.153 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.39 105.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.956 0.408 . . . . 0.0 111.201 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.476 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -122.05 130.47 53.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.185 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 18.4 m -94.77 120.62 35.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.889 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.476 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.29 109.35 1.86 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.013 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 55.4 p -68.9 -26.21 64.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.09 0.472 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 5.1 p -140.37 161.74 53.39 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.873 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.751 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.4 Cg_exo -44.05 110.78 0.22 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.414 2.076 . . . . 0.0 112.426 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.774 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.8 m -127.71 134.34 49.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -84.4 156.09 21.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.079 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.561 ' O ' ' N ' ' A' ' 584' ' ' GLU . 41.7 t -90.33 118.07 29.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.783 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -56.83 -20.36 22.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.368 179.769 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 582' ' ' GLU . . . . . 0.44 ' HB2' HD12 ' A' ' 612' ' ' LEU . 5.2 tm-20 -78.11 -57.69 3.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.165 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.9 p -117.71 16.28 14.46 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 580' ' ' CYS . 56.2 mt-10 46.26 52.07 10.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.753 0.311 . . . . 0.0 111.128 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.12 123.03 4.87 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.013 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.751 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.9 tp -46.3 133.24 9.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.783 0.325 . . . . 0.0 111.245 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.774 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -93.73 41.94 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.79 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -111.01 -165.91 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.708 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 589' ' ' GLY . . . . . 0.557 ' O ' HD13 ' A' ' 590' ' ' ILE . . . 110.47 -74.18 0.21 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.509 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 590' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 589' ' ' GLY . 39.8 mm -132.58 -61.18 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.814 0.34 . . . . 0.0 111.127 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.68 90.29 3.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.261 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.3 ptt180 -53.6 -21.56 6.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.116 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 44.4 tt0 -41.41 156.15 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.716 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -170.0 -171.07 35.14 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.594 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.3 mmm -123.4 144.52 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 14.4 ttt180 -146.78 141.05 26.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.416 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.524 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.1 t -79.04 141.09 37.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.168 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.532 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.0 p -96.84 29.73 2.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.384 . . . . 0.0 110.775 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.42 -41.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.903 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.3 m -113.42 -21.04 11.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.096 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.67 3.96 76.75 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.653 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.715 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.3 p -60.83 119.4 4.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.467 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -104.85 138.76 40.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.835 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.1 p -148.66 177.94 9.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.941 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -74.14 -177.45 2.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.273 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 606' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -73.36 -33.07 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.704 0.288 . . . . 0.0 111.229 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -90.69 -33.53 15.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.743 ' HA ' HD12 ' A' ' 611' ' ' LEU . 53.0 m -68.66 -25.4 64.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.424 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 609' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.1 OUTLIER -57.18 -27.87 62.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.85 0.357 . . . . 0.0 110.684 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.26 -32.31 15.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.534 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.0 mt -75.93 -32.81 59.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.061 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 582' ' ' GLU . 0.9 OUTLIER -57.7 136.3 56.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.073 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.68 169.0 5.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.536 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -111.95 148.04 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.151 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -161.1 39.67 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.847 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.841 179.983 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.787 0.327 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.467 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.4 m-70 -58.99 134.82 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.899 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -76.64 63.44 2.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.938 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.479 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.4 m-85 -61.48 113.76 2.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -114.55 152.07 32.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.023 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.6 t -62.4 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 111.253 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.707 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.23 131.19 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.242 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -96.92 117.33 30.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.707 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.56 112.17 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.076 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 61.8 p -72.78 -29.22 63.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.054 0.455 . . . . 0.0 110.077 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.3 p -130.1 162.16 55.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.53 ' CB ' HD11 ' A' ' 586' ' ' LEU . 6.7 Cg_endo -49.19 110.44 0.36 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.46 2.107 . . . . 0.0 112.093 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.584 ' O ' HD12 ' A' ' 587' ' ' LEU . 88.7 m -126.17 140.71 52.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -92.02 156.09 17.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.258 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 584' ' ' GLU . 46.4 t -84.21 122.98 29.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.804 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.688 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -62.17 -15.08 43.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.234 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.54 -57.58 2.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -114.7 14.05 17.46 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 580' ' ' CYS . 41.7 mt-10 47.53 51.57 13.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.033 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.32 122.1 4.81 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.949 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.53 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.31 133.78 9.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.81 0.338 . . . . 0.0 111.43 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.615 HD23 ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.38 41.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.82 -166.74 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.878 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.68 -80.95 0.28 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.551 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 6.5 mt -125.07 -61.75 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.736 0.303 . . . . 0.0 111.205 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.4 90.42 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER -54.09 -21.66 9.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.133 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.3 tt0 -43.56 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.666 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -168.51 -169.75 32.33 Favored Glycine 0 C--N 1.33 0.201 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.603 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.479 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 68.1 mmm -124.32 144.25 50.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 13.2 ttt180 -146.7 141.43 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.986 0.422 . . . . 0.0 111.274 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.558 ' HB3' HG12 ' A' ' 602' ' ' VAL . 49.2 t -76.96 143.81 39.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.318 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 31.31 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.403 . . . . 0.0 110.646 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -140.05 -40.39 0.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.8 m -110.23 -19.45 13.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.025 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.65 -5.76 84.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.703 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.688 HG23 ' CG ' ' A' ' 581' ' ' TYR . 13.5 p -54.45 145.82 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.613 0.244 . . . . 0.0 111.087 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -127.72 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 110.739 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 604' ' ' CYS . . . . . 0.403 ' HB3' HD12 ' A' ' 612' ' ' LEU . 1.3 p -148.58 178.08 8.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.615 ' CD2' HD23 ' A' ' 587' ' ' LEU . 38.6 m80 -76.94 177.94 7.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.421 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.58 -38.02 89.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.735 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -41.49 11.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.083 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.583 ' HA ' HD12 ' A' ' 611' ' ' LEU . 58.8 m -56.99 -20.97 26.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.508 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -54.65 -35.64 63.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -87.84 -33.77 18.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.47 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 608' ' ' CYS . 10.6 mt -70.67 -30.57 67.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.984 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.2 tt -58.63 151.93 19.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.109 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.58 ' N ' HD23 ' A' ' 612' ' ' LEU . 6.9 m-20 -61.25 -168.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.89 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -150.81 143.49 24.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.152 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -167.39 39.47 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.813 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.85 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.812 0.339 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.4 m-70 -59.06 133.85 56.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.971 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -77.45 61.55 2.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.946 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.731 ' HE1' HG13 ' A' ' 602' ' ' VAL . 25.7 m-85 -61.52 117.3 5.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.715 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.77 154.02 31.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.997 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.35 105.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.015 0.436 . . . . 0.0 111.382 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.746 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.24 129.41 52.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.361 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.523 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.7 m -96.09 117.5 30.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.381 . . . . 0.0 110.615 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.746 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.62 111.77 2.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.234 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 23.4 p -71.85 -24.14 61.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.119 0.485 . . . . 0.0 110.162 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 4.0 p -134.99 161.16 65.34 Favored Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.016 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.548 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.33 111.15 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.614 2.209 . . . . 0.0 112.103 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 587' ' ' LEU . 44.2 m -128.68 133.75 48.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 579' ' ' TYR . . . . . 0.477 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.4 m-85 -85.22 156.16 21.1 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.255 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 584' ' ' GLU . 47.8 t -85.4 122.36 29.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.514 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -60.82 -16.6 42.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.387 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.38 -57.71 3.04 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.4 p -113.18 13.71 19.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.2 mm-40 47.19 51.43 13.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 111.134 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.48 125.72 5.69 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.524 -0.845 . . . . 0.0 112.969 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.548 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.3 tp -46.25 134.68 8.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.112 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 578' ' ' THR . 2.1 mp -94.55 38.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.44 31.56 5.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.949 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -90.27 81.54 1.38 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.275 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 2.4 mp 68.86 -69.02 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.766 0.317 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -92.21 93.05 8.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.217 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.4 OUTLIER -51.63 -23.05 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.238 179.695 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.523 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.8 tt0 -45.89 149.99 0.6 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.387 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -161.29 -169.88 25.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.6 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.471 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 66.7 mmm -123.08 145.45 48.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.7 ttt180 -146.74 141.69 27.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.857 0.36 . . . . 0.0 111.107 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.504 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.5 t -78.08 143.46 37.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.409 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.2 p -98.92 31.41 2.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.601 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.95 -41.36 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.47 -22.7 10.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.999 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 89.37 7.57 69.42 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.646 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.731 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.6 p -65.05 122.38 15.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.843 0.354 . . . . 0.0 110.841 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.47 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.9 OUTLIER -105.87 139.71 40.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.935 0.398 . . . . 0.0 110.877 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.2 p -148.46 177.96 9.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.403 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 45.6 m80 -74.69 175.91 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.204 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -37.84 88.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.414 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -90.64 -37.96 13.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.897 0.38 . . . . 0.0 111.264 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.504 ' HA ' HD12 ' A' ' 611' ' ' LEU . 14.5 m -60.04 -19.65 53.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.449 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -54.74 -32.83 60.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.901 0.381 . . . . 0.0 110.639 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.66 -33.9 14.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.515 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.9 mt -70.14 -29.14 65.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.049 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.546 HD23 ' N ' ' A' ' 613' ' ' ASN . 0.9 OUTLIER -56.99 152.45 13.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.161 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.546 ' N ' HD23 ' A' ' 612' ' ' LEU . 14.5 p-10 -80.48 118.29 21.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.75 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -66.76 143.99 56.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.144 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -170.49 59.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.825 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.758 0.313 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 97.2 m-70 -59.2 135.82 57.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 568' ' ' ASN . . . . . 0.503 ' O ' HG23 ' A' ' 598' ' ' THR . 0.9 OUTLIER -71.54 65.74 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.178 0.513 . . . . 0.0 109.904 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.663 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.9 m-85 -65.76 123.91 21.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.605 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.586 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -124.52 149.76 46.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.167 179.537 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.5 105.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 111.31 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.85 134.91 54.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.251 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 3.4 m -96.03 121.38 37.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 110.93 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.537 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.72 109.44 3.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 45.4 p -70.1 -26.69 64.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.118 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.415 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 19.5 p -137.08 160.49 65.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.068 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.806 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.6 Cg_exo -45.33 110.9 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.327 2.018 . . . . 0.0 112.35 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 99.8 m -126.4 129.92 49.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.08 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 579' ' ' TYR . . . . . 0.497 ' CE1' HD13 ' A' ' 586' ' ' LEU . 29.7 m-85 -83.66 156.02 22.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.172 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.5 t -84.21 125.17 31.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.61 ' HB3' HD11 ' A' ' 612' ' ' LEU . 0.1 OUTLIER -64.54 -12.37 43.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -89.37 -57.57 2.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.6 p -114.75 14.28 17.44 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.6 mm-40 47.74 51.46 14.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.846 0.355 . . . . 0.0 110.965 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.03 120.54 4.5 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.974 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.7 tp -46.3 134.41 8.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 111.315 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.62 39.75 1.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.763 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -109.2 -165.69 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.801 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.98 -80.6 0.27 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 47.6 mt -126.0 -61.98 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 0.0 111.099 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.63 90.58 4.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.19 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.4 ptp180 -53.08 -21.84 5.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.183 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 17.3 tt0 -43.04 156.66 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.75 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -169.32 -170.37 33.79 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.465 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.52 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.91 146.26 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -146.7 140.78 26.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.063 0.459 . . . . 0.0 111.105 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.481 ' HB3' HG12 ' A' ' 602' ' ' VAL . 54.0 t -76.47 144.61 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.585 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.586 HG22 ' HG2' ' A' ' 570' ' ' GLU . 10.4 p -98.65 30.35 3.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.0 110.88 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -141.29 -40.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.035 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.7 m -112.39 -18.78 12.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 82.96 8.97 85.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.569 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.663 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.8 p -65.73 119.47 10.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -101.67 138.54 38.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.936 0.398 . . . . 0.0 111.001 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 604' ' ' CYS . . . . . 0.507 ' HB3' HD12 ' A' ' 612' ' ' LEU . 1.0 OUTLIER -148.71 178.07 8.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.026 -179.601 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.442 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.6 m80 -76.35 178.15 6.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.231 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.48 -52.09 64.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.594 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -82.46 -39.27 22.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.995 0.426 . . . . 0.0 111.223 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 90.6 m -56.76 -21.41 28.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.329 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -53.86 -41.5 67.56 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.26 -34.5 36.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.474 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 33.7 mt -69.48 -31.64 70.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.965 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.75 HD23 ' N ' ' A' ' 613' ' ' ASN . 2.0 tt -59.14 154.64 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.063 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.75 ' N ' HD23 ' A' ' 612' ' ' LEU . 13.1 m120 -60.72 -177.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.729 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -139.99 140.2 36.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.39 39.57 0.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.818 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.865 -179.941 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.772 0.32 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.465 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.7 m-70 -59.28 130.61 47.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.982 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 568' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 598' ' ' THR . 2.6 t30 -78.33 61.24 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.196 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.638 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.5 m-85 -61.3 119.49 8.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.418 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.498 ' CD ' HG21 ' A' ' 598' ' ' THR . 61.6 mt-10 -118.93 155.22 31.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.233 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.37 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.409 . . . . 0.0 111.139 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.477 ' CH2' ' HD2' ' A' ' 603' ' ' LYS . 0.4 OUTLIER -123.43 123.19 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.249 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.789 HG22 ' HD2' ' A' ' 592' ' ' ARG . 22.3 m -89.71 116.96 28.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.827 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.469 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -59.3 109.43 0.87 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -25.13 64.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.174 0.511 . . . . 0.0 110.058 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.435 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 12.3 p -138.42 160.63 62.93 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.737 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.516 ' CB ' HD11 ' A' ' 586' ' ' LEU . 3.8 Cg_endo -46.72 110.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.517 2.145 . . . . 0.0 112.128 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.511 HG21 ' HZ3' ' A' ' 603' ' ' LYS . 96.9 m -127.66 134.34 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -83.33 156.14 23.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.008 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -88.13 118.56 27.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.763 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.429 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -57.38 -19.94 26.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.324 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -79.51 -57.79 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -116.65 16.8 15.41 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 580' ' ' CYS . 42.2 mt-10 45.75 51.75 10.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 0.0 111.221 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.64 124.47 5.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.89 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.516 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.33 133.83 9.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.853 0.358 . . . . 0.0 111.238 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 605' ' ' HIS . 0.5 OUTLIER -94.03 39.22 1.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.479 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.86 160.9 15.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.816 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 121.78 81.86 0.62 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.542 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 21.2 mt 69.34 -65.76 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 0.0 111.408 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.7 88.67 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 111.597 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.789 ' HD2' HG22 ' A' ' 573' ' ' THR . 8.3 ptt180 -62.33 -18.09 60.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.034 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.6 tt0 -37.83 156.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.19 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.49 -175.95 40.2 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.446 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.2 mmm -122.31 144.6 48.9 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 10.4 ttt180 -146.61 141.52 27.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.891 0.377 . . . . 0.0 111.498 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.659 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.3 t -77.27 144.38 38.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.347 179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.498 HG21 ' CD ' ' A' ' 570' ' ' GLU . 13.5 p -99.01 31.03 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.954 0.407 . . . . 0.0 110.799 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.12 -40.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.253 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.0 m -111.17 -15.12 13.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.285 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 84.42 -4.08 84.87 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.699 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.659 HG12 ' HB3' ' A' ' 597' ' ' CYS . 9.2 p -54.58 142.45 8.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.675 0.274 . . . . 0.0 111.011 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.511 ' HZ3' HG21 ' A' ' 578' ' ' THR . 1.6 mttp -127.41 139.49 52.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.797 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.5 p -148.71 177.94 9.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.15 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.523 ' HA ' HD21 ' A' ' 587' ' ' LEU . 47.5 m80 -74.1 176.74 6.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.53 78.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.458 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -90.69 -43.54 10.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.043 0.449 . . . . 0.0 111.263 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 52.7 m -55.75 -22.13 22.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.657 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -55.74 -34.79 65.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.673 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -87.59 -32.36 19.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.476 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 20.2 mt -72.65 -31.82 65.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 613' ' ' ASN . 0.7 OUTLIER -58.66 144.46 43.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.025 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.44 ' N ' HD23 ' A' ' 612' ' ' LEU . 2.2 m-20 -66.44 164.09 17.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.751 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -120.55 139.03 53.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.183 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -171.26 39.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.786 0.327 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.0 m-70 -58.92 135.1 57.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -72.42 63.9 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 109.919 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.498 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 19.4 m-85 -64.87 120.34 12.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.666 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.469 ' HG2' HG23 ' A' ' 598' ' ' THR . 1.1 pt-20 -120.9 151.11 40.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.049 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.42 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.969 0.414 . . . . 0.0 111.238 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.777 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.22 130.69 53.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.347 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -96.68 117.47 31.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 110.835 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.777 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.31 112.37 3.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.8 p -72.25 -24.72 61.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.97 0.414 . . . . 0.0 110.256 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 21.9 p -136.39 160.19 67.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.155 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.743 ' HB3' HD11 ' A' ' 586' ' ' LEU . 85.8 Cg_exo -45.5 111.64 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.481 2.121 . . . . 0.0 112.564 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.722 ' O ' HD12 ' A' ' 587' ' ' LEU . 49.2 m -128.32 132.41 48.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -83.5 156.1 23.02 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.238 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.7 t -86.11 124.73 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.782 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -63.35 -13.87 43.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.267 179.864 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -88.14 -57.63 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.1 p -113.91 13.47 18.33 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 24.3 mt-10 47.78 46.48 18.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.856 0.36 . . . . 0.0 111.068 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -119.33 121.97 5.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.996 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.6 tp -46.23 135.81 7.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.816 0.341 . . . . 0.0 111.346 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.722 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -94.02 38.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.482 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -113.55 17.9 17.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.365 -179.629 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -57.49 -65.39 3.59 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.381 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 62.4 mt -139.98 -60.46 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.825 0.345 . . . . 0.0 110.593 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -97.78 93.06 6.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.697 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.482 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER -43.72 -27.67 0.34 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 179.963 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.529 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 8.8 tt0 -49.57 139.68 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.116 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -150.4 -167.77 14.74 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.675 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 74.8 mmm -120.14 146.18 46.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.603 0.239 . . . . 0.0 110.427 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.7 ttt180 -146.57 140.57 26.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.018 0.437 . . . . 0.0 111.358 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.646 ' HB3' HG12 ' A' ' 602' ' ' VAL . 54.1 t -78.86 140.5 38.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.469 HG23 ' HG2' ' A' ' 570' ' ' GLU . 80.3 p -96.8 29.24 3.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.883 0.373 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -136.73 -40.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.051 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.4 m -110.64 -12.46 14.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.17 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 78.49 5.73 87.97 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.469 -0.872 . . . . 0.0 112.739 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.646 HG12 ' HB3' ' A' ' 597' ' ' CYS . 11.7 p -65.87 145.81 13.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.577 0.227 . . . . 0.0 110.981 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.477 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.3 mttm -127.18 139.13 53.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.949 0.404 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.58 177.94 9.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.205 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.401 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 44.8 m80 -73.6 175.31 7.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.243 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.98 -37.36 87.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.672 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.43 -32.79 16.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.43 ' HA ' HD12 ' A' ' 611' ' ' LEU . 5.4 m -65.13 -19.35 65.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.472 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -53.5 -32.61 51.06 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.951 0.405 . . . . 0.0 110.65 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -93.61 -37.18 12.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.516 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 608' ' ' CYS . 12.7 mt -66.86 -27.88 67.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.095 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.53 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.0 OUTLIER -56.58 151.3 13.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.099 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.53 ' N ' HD23 ' A' ' 612' ' ' LEU . 82.4 m-20 -76.23 111.02 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.892 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -71.43 141.12 50.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.112 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -177.3 39.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.899 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.4 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 65.9 tt0 . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 98.0 m-70 -59.08 134.29 56.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.927 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -77.99 61.43 2.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.107 0.48 . . . . 0.0 110.195 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.703 ' CE1' HG13 ' A' ' 602' ' ' VAL . 31.5 m-85 -61.44 124.24 20.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.368 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.4 ' HG3' ' CG2' ' A' ' 598' ' ' THR . 7.0 mm-40 -122.9 154.63 38.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.235 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 28.3 t -62.41 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.011 0.434 . . . . 0.0 110.925 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.799 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.6 OUTLIER -124.34 131.62 53.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.458 179.854 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 32.2 m -99.55 116.78 32.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.002 0.43 . . . . 0.0 110.678 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.799 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.32 119.05 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.205 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 19.6 p -76.04 -26.27 56.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 0.0 110.072 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 p -135.4 160.47 67.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.93 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.816 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.1 Cg_exo -45.51 111.61 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.321 2.014 . . . . 0.0 112.512 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.7 m -129.31 128.36 43.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -78.41 156.06 29.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.538 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.8 t -88.56 119.98 29.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.444 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -58.37 -18.73 29.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.332 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -80.81 -57.75 3.41 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.7 p -115.83 15.89 16.31 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 580' ' ' CYS . 43.8 mt-10 46.06 48.0 12.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 111.232 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.89 124.64 5.83 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.995 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.0 tp -46.26 133.35 9.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.362 . . . . 0.0 111.249 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.638 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.34 39.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.858 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.469 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.88 30.57 6.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.961 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.49 80.37 1.62 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.219 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 5.1 mt 68.98 -68.58 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.715 0.293 . . . . 0.0 111.099 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -91.83 93.29 8.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.902 0.382 . . . . 0.0 111.162 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.469 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 6.8 ptt180 -51.81 -22.84 4.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.321 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 22.1 tt0 -44.98 154.29 0.15 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.465 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.02 -165.41 24.37 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.758 -0.735 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.448 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.7 mmm -127.43 143.82 51.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.414 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 10.8 ttt180 -146.54 140.49 26.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.028 0.442 . . . . 0.0 111.44 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.557 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.7 t -77.12 141.59 40.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.352 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.4 ' CG2' ' HG3' ' A' ' 570' ' ' GLU . 73.2 p -97.75 30.56 2.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.98 0.419 . . . . 0.0 110.787 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -138.33 -40.03 0.52 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.097 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.5 m -113.15 -21.13 11.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.064 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.11 0.01 78.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.625 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.703 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.1 p -58.57 126.6 16.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.966 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.6 OUTLIER -112.09 139.37 47.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.59 177.84 9.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.006 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -73.64 174.03 8.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.254 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.09 -36.93 85.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.542 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.54 -38.7 13.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 111.368 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.412 ' HA ' HD12 ' A' ' 611' ' ' LEU . 8.5 m -59.53 -20.1 53.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.55 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -55.95 -39.52 71.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.949 0.404 . . . . 0.0 110.683 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -82.51 -34.72 27.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.491 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 608' ' ' CYS . 17.8 mt -70.49 -30.99 67.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.543 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.0 OUTLIER -59.88 146.66 41.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.997 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.543 ' N ' HD23 ' A' ' 612' ' ' LEU . 3.2 m-20 -60.86 -171.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.839 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.4 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -148.71 146.37 28.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.148 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -170.69 39.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.925 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.825 0.345 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 98.1 m-70 -59.72 134.52 57.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 568' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 598' ' ' THR . 3.4 t30 -73.01 64.61 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.179 0.514 . . . . 0.0 110.059 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.69 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.6 m-85 -64.7 122.18 16.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.628 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.543 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -122.54 150.93 41.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.322 179.507 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.4 105.53 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.971 0.415 . . . . 0.0 111.251 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.487 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.37 132.4 53.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.272 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -94.79 121.79 36.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.005 0.431 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.487 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.23 109.42 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 33.6 p -69.11 -27.9 65.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.06 0.457 . . . . 0.0 109.933 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.424 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.8 p -135.98 162.14 58.47 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.851 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.664 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.0 Cg_endo -47.65 110.47 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.44 2.094 . . . . 0.0 112.043 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.724 ' O ' HD12 ' A' ' 587' ' ' LEU . 97.7 m -124.91 131.26 53.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -81.29 156.11 25.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.029 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -86.86 122.76 31.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.794 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.595 ' HB3' HD11 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -61.98 -14.6 36.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.372 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 582' ' ' GLU . . . . . 0.677 ' HB2' HD12 ' A' ' 612' ' ' LEU . 1.9 tm-20 -87.99 -57.68 2.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.912 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.6 p -113.22 14.15 19.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.8 mm-40 46.81 48.57 14.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 0.0 111.22 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.45 123.55 5.53 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.967 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.664 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.3 tp -46.24 134.39 8.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.866 0.365 . . . . 0.0 111.397 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.724 HD12 ' O ' ' A' ' 578' ' ' THR . 1.2 mp -93.66 40.0 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.468 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -111.03 -166.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.846 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.91 -72.93 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.584 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 4.4 mp -133.85 -60.5 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.861 0.362 . . . . 0.0 111.179 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -102.88 89.91 3.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.201 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.468 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt-85 -52.84 -22.04 4.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.224 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 9.7 tt0 -42.41 153.6 0.07 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.711 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.42 -170.21 31.96 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.527 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.5 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.5 mmm -123.07 143.7 49.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.419 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 3.8 ttt-85 -144.76 140.96 28.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.019 0.438 . . . . 0.0 111.167 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.483 ' HB3' HG12 ' A' ' 602' ' ' VAL . 52.8 t -76.06 144.34 40.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.482 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.543 HG22 ' HG2' ' A' ' 570' ' ' GLU . 12.9 p -98.82 30.79 3.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -140.78 -40.69 0.41 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.027 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.63 -20.14 11.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.166 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.27 4.39 83.82 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.626 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.69 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.4 p -61.47 120.88 8.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.825 0.345 . . . . 0.0 110.837 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -105.35 138.47 41.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 111.065 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.72 177.83 9.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.806 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.406 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 47.2 m80 -73.56 -176.85 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.111 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.88 -37.04 67.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.655 0.264 . . . . 0.0 111.366 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -32.53 16.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.891 0.377 . . . . 0.0 111.262 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 611' ' ' LEU . 54.3 m -71.19 -24.79 62.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.339 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -28.01 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.96 -34.54 13.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.558 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.9 mt -72.87 -28.14 62.32 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.007 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.0 OUTLIER -54.53 153.72 5.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.189 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.456 ' N ' HD23 ' A' ' 612' ' ' LEU . 10.6 m-80 -78.69 131.41 36.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -80.11 142.0 35.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -154.77 38.67 0.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.995 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.845 0.355 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.472 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 89.4 m-70 -63.38 120.64 12.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.064 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 568' ' ' ASN . . . . . 0.485 ' O ' HG23 ' A' ' 598' ' ' THR . 30.1 t30 -75.62 63.63 1.58 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.127 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.709 ' CE1' HG13 ' A' ' 602' ' ' VAL . 38.3 m-85 -61.35 113.44 2.64 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.195 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.478 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.5 OUTLIER -114.21 156.86 23.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.151 179.489 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.43 105.29 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.974 0.416 . . . . 0.0 110.938 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.905 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -121.99 133.9 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.378 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.82 HG22 ' HD3' ' A' ' 592' ' ' ARG . 6.2 m -98.72 117.52 33.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.683 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.905 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.15 114.02 5.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.176 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 56.1 p -72.97 -25.33 60.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.01 0.433 . . . . 0.0 110.169 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.7 p -134.18 159.85 70.76 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.144 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.797 ' HB3' HD11 ' A' ' 586' ' ' LEU . 89.1 Cg_exo -46.35 112.38 0.46 Allowed 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.439 2.093 . . . . 0.0 112.44 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.734 ' O ' HD12 ' A' ' 587' ' ' LEU . 42.9 m -128.35 134.18 48.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.822 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 579' ' ' TYR . . . . . 0.444 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -86.11 156.22 20.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.311 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.479 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.9 t -84.99 123.56 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.121 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.666 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -61.19 -15.39 33.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.365 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -88.08 -57.67 2.85 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.0 p -112.45 13.33 20.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 580' ' ' CYS . 76.1 mm-40 47.1 50.06 14.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.772 0.32 . . . . 0.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.78 124.38 5.66 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.034 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.797 HD11 ' HB3' ' A' ' 577' ' ' PRO . 17.1 tp -46.3 135.02 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.329 . . . . 0.0 111.292 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -94.67 39.12 1.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.496 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.19 142.32 38.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.77 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 139.69 87.52 0.15 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.501 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 11.2 mt 68.31 -69.13 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.723 0.297 . . . . 0.0 111.299 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.17 87.83 3.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.92 0.391 . . . . 0.0 111.334 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.82 ' HD3' HG22 ' A' ' 573' ' ' THR . 0.1 OUTLIER -59.18 -18.9 40.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.19 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.4 OUTLIER -40.63 159.98 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.892 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -173.1 -170.0 36.23 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.589 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 68.4 mmm -122.15 143.91 49.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt180 -146.73 142.01 27.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.913 0.387 . . . . 0.0 111.504 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.641 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.4 t -78.28 142.59 37.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.166 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.485 HG23 ' O ' ' A' ' 568' ' ' ASN . 2.6 p -98.16 30.5 3.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.916 0.388 . . . . 0.0 110.785 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -138.32 -40.26 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.217 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.8 m -111.54 -20.25 12.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.74 -4.19 81.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.615 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.709 HG13 ' CE1' ' A' ' 569' ' ' PHE . 13.7 p -54.5 145.15 4.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.608 0.242 . . . . 0.0 110.922 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.475 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.7 141.89 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.927 0.394 . . . . 0.0 110.767 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.36 178.07 8.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.046 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -76.82 178.7 6.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.27 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -66.84 -36.64 82.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.645 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -34.61 15.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.408 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.9 m -64.38 -21.82 66.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.502 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -56.3 -37.24 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 110.655 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -35.54 27.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.458 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 36.5 mt -69.37 -33.17 72.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.5 137.55 58.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.887 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -178.14 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.402 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -126.47 140.95 52.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.072 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -165.41 53.94 0.11 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.932 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.848 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.786 0.327 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.488 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 94.2 m-70 -65.88 128.28 35.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.038 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 568' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 598' ' ' THR . 3.3 t30 -78.83 63.4 3.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.028 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.488 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 38.6 m-85 -61.29 115.95 4.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.392 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.67 154.76 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.108 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.36 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.938 0.399 . . . . 0.0 111.265 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.751 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 1.2 t90 -122.64 129.2 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.408 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.538 HG23 ' HA ' ' A' ' 593' ' ' GLN . 19.7 m -97.87 116.95 31.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.688 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.751 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.42 119.13 9.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.165 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 29.0 p -77.15 -26.88 53.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.106 0.479 . . . . 0.0 110.118 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 17.6 p -134.44 160.8 67.09 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.944 179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.807 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.3 Cg_exo -45.36 111.09 0.29 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.399 2.066 . . . . 0.0 112.402 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 587' ' ' LEU . 56.2 m -129.83 125.01 34.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.977 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -75.28 156.04 36.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.251 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' A' ' 584' ' ' GLU . 52.3 t -86.65 120.26 27.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.807 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -57.96 -18.65 24.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.357 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -83.12 -57.74 3.15 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.08 15.04 18.4 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mp0 46.32 47.77 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 111.26 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.33 125.24 6.09 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.859 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.6 tp -46.21 133.6 9.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.872 0.368 . . . . 0.0 111.266 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.06 38.62 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.35 29.91 6.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.925 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.75 80.41 1.59 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.259 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 51.8 mt 69.2 -67.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.764 0.316 . . . . 0.0 111.173 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -92.41 92.99 8.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.5 ptp180 -52.77 -22.73 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.225 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.538 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.2 tt0 -45.23 154.02 0.18 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.389 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.48 -170.37 31.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.693 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.422 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 59.7 mmm -124.38 144.69 49.89 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.5 ttt180 -146.62 142.0 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.924 0.393 . . . . 0.0 111.201 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.608 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.3 t -76.43 142.99 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.388 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 568' ' ' ASN . 18.7 p -98.83 31.39 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.965 0.412 . . . . 0.0 110.684 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -139.75 -39.72 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.114 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.1 m -111.14 -20.79 12.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.179 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 91.01 -5.12 81.85 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.596 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.619 HG23 ' CG ' ' A' ' 581' ' ' TYR . 11.6 p -54.42 142.44 8.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.602 0.239 . . . . 0.0 111.04 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.2 OUTLIER -127.02 140.45 52.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -148.61 177.9 9.09 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.45 ' HA ' HD21 ' A' ' 587' ' ' LEU . 50.4 m80 -72.82 176.03 5.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.269 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -64.38 -35.63 81.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.496 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -43.25 10.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.425 . . . . 0.0 111.222 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.814 ' HA ' HD12 ' A' ' 611' ' ' LEU . 20.1 m -55.27 -22.32 17.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.623 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -54.01 -39.46 66.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.925 0.393 . . . . 0.0 110.74 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -32.51 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.439 179.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.7 mt -71.04 -30.33 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.05 133.17 55.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.01 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -72.02 134.49 45.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -67.26 152.22 46.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -176.04 40.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.901 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.948 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.523 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 16.1 tt0 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.753 0.311 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 98.6 m-70 -59.61 137.98 57.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -75.45 62.95 1.41 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.103 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.688 ' HE1' HG13 ' A' ' 602' ' ' VAL . 24.9 m-85 -66.23 122.73 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.484 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.617 ' OE1' HG21 ' A' ' 598' ' ' THR . 18.3 mt-10 -122.19 155.42 35.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.4 105.33 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.957 0.408 . . . . 0.0 111.17 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.93 129.29 51.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.295 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.7 m -96.06 117.14 30.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 0.0 110.693 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.12 110.66 2.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.056 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.1 p -69.5 -24.21 63.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.199 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.2 p -137.36 160.01 67.2 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.039 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.754 ' HB3' HD11 ' A' ' 586' ' ' LEU . 87.5 Cg_exo -46.18 111.9 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.401 2.067 . . . . 0.0 112.473 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 73.3 m -129.6 135.85 49.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.917 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -85.02 156.11 21.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.404 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.51 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.5 t -86.8 122.01 30.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.592 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -60.3 -16.51 35.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.427 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -83.98 -57.6 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 20.4 p -115.44 14.94 16.79 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 580' ' ' CYS . 6.1 mt-10 46.46 51.8 11.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.331 . . . . 0.0 111.165 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.55 123.83 5.22 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.956 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.754 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.5 tp -46.29 133.79 9.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 111.253 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.98 39.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.001 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.466 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.85 35.89 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -97.06 84.08 0.77 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.363 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 39.3 mm 68.73 -69.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.712 0.291 . . . . 0.0 111.213 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -93.71 92.54 7.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.881 0.372 . . . . 0.0 111.235 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.466 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt85 -50.96 -23.12 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.232 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 4.4 tt0 -45.0 155.63 0.11 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.425 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.31 -167.88 26.6 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.626 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.427 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.4 mmm -126.24 143.24 51.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 7.3 ttt180 -146.69 141.43 26.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.383 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.574 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.8 t -77.15 143.16 39.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.617 HG21 ' OE1' ' A' ' 570' ' ' GLU . 28.5 p -98.46 30.61 3.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.877 0.37 . . . . 0.0 110.724 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -139.14 -40.37 0.47 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.121 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.7 m -110.37 -17.67 13.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.67 -5.0 85.77 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.67 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' HE1' ' A' ' 569' ' ' PHE . 12.4 p -54.5 142.86 7.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 O-C-N 122.734 -0.274 . . . . 0.0 111.023 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.7 mttp -126.53 140.44 52.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.857 0.361 . . . . 0.0 110.801 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.56 177.97 9.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.05 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -75.31 176.82 7.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.08 -41.85 94.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.514 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -38.76 13.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.035 0.445 . . . . 0.0 111.142 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 88.4 m -59.03 -20.52 53.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.12 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.02 -42.0 75.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.994 0.426 . . . . 0.0 110.385 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.6 -33.93 58.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.138 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 56.4 mt -71.04 -30.21 66.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.978 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.476 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.3 tt -57.56 146.19 31.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.097 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.476 ' N ' HD23 ' A' ' 612' ' ' LEU . 5.1 p-10 -71.67 116.89 12.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.523 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -85.24 146.02 27.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.141 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -176.64 40.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.821 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.862 0.363 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.478 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.2 m-70 -60.3 126.56 27.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -77.8 62.66 2.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.126 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.631 ' CE1' HG13 ' A' ' 602' ' ' VAL . 36.7 m-85 -61.35 114.88 3.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.323 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 598' ' ' THR . 2.7 pp20? -113.7 153.7 28.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.077 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.3 105.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 111.071 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.42 130.81 53.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.272 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -93.39 119.61 32.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.412 . . . . 0.0 110.913 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.488 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.31 109.49 1.92 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.261 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.2 p -72.12 -27.86 62.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.022 0.439 . . . . 0.0 109.982 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.44 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.7 p -133.4 162.23 58.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.911 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.528 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.5 110.45 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.413 2.075 . . . . 0.0 112.053 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.78 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.7 m -125.68 130.97 52.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.192 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 579' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 586' ' ' LEU . 28.4 m-85 -84.25 156.12 22.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.925 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.4 t -85.44 123.13 30.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.912 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -62.96 -14.09 42.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -88.99 -57.66 2.82 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.37 13.16 20.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 13.5 mt-10 47.42 51.35 13.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.27 122.81 4.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.951 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.528 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.25 134.36 8.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 111.288 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.78 HD12 ' O ' ' A' ' 578' ' ' THR . 1.3 mp -94.12 38.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.65 -167.89 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.81 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 111.78 -77.51 0.24 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.515 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 590' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 590' ' ' ILE . 4.4 mp -129.28 -61.69 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 111.097 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.25 90.31 4.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.2 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER -54.15 -21.8 9.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.119 179.608 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.526 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 1.1 tt0 -43.14 154.48 0.07 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.682 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.76 -163.71 22.15 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.689 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.408 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.6 mmm -129.44 144.56 51.3 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 22.5 ttt-85 -146.65 140.48 26.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.974 0.416 . . . . 0.0 111.308 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.5 t -75.67 142.77 42.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.397 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 570' ' ' GLU . 19.4 p -98.49 30.97 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.654 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -139.37 -40.01 0.47 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.239 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.16 -20.58 12.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.56 -5.18 82.51 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.684 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.669 HG23 ' CG ' ' A' ' 581' ' ' TYR . 12.0 p -54.36 145.67 4.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 CA-C-N 116.744 0.272 . . . . 0.0 110.954 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.48 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.73 141.13 51.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.895 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.6 p -148.42 178.06 8.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.125 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -74.97 175.76 7.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.354 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -63.63 -37.7 88.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.593 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 607' ' ' LYS . . . . . 0.601 ' HG2' HD11 ' A' ' 611' ' ' LEU . 8.3 tttt -90.47 -40.3 12.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.952 0.406 . . . . 0.0 111.184 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.816 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.4 m -58.24 -19.87 37.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.398 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -54.97 -33.69 62.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.965 0.412 . . . . 0.0 110.606 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -90.44 -33.8 15.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.38 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.7 mt -71.27 -29.52 65.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.04 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.445 HD11 ' HB3' ' A' ' 581' ' ' TYR . 1.2 tt -58.59 144.56 42.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.107 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.443 ' N ' HD23 ' A' ' 612' ' ' LEU . 4.7 t-20 -65.5 -174.15 0.18 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.784 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -130.92 142.13 50.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.136 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -176.18 39.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.918 179.95 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.802 0.334 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.484 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.4 m-70 -58.87 131.55 51.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.976 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -73.66 63.39 0.84 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.113 0.482 . . . . 0.0 110.187 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.688 ' CE1' HG13 ' A' ' 602' ' ' VAL . 28.9 m-85 -66.47 115.77 6.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.292 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -114.23 155.09 26.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.113 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 33.4 t -62.37 105.21 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.952 0.406 . . . . 0.0 111.044 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.538 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.14 132.59 54.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.18 119.24 34.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.943 0.401 . . . . 0.0 110.857 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.538 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -66.08 109.48 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.094 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 1.9 p -70.78 -30.25 66.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.114 0.483 . . . . 0.0 110.017 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 1.4 p -131.64 162.98 52.93 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.952 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.602 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.1 110.54 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.465 2.11 . . . . 0.0 112.146 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.801 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.9 m -125.48 134.29 52.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -85.08 156.06 21.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.852 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.53 ' O ' ' N ' ' A' ' 584' ' ' GLU . 51.4 t -87.9 120.53 29.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.991 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.629 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -58.87 -18.08 29.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.351 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -83.02 -57.7 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -179.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.1 p -114.98 14.28 17.14 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.4 mt-10 46.97 51.45 12.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.58 123.49 5.11 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.938 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.602 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.26 131.59 10.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.85 0.357 . . . . 0.0 111.207 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.801 HD12 ' O ' ' A' ' 578' ' ' THR . 1.9 mp -93.48 42.72 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.47 29.32 7.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -87.3 80.47 1.71 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.376 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 19.4 mt 69.32 -66.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.777 0.322 . . . . 0.0 111.185 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -94.49 91.88 6.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 588' ' ' TRP . 3.0 ptt180 -49.53 -24.73 2.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.282 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.1 tt0 -45.02 152.6 0.23 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.695 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.71 -158.92 10.68 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.423 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 63.9 mmm -131.32 144.66 51.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.46 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.0 ttt-85 -146.51 140.7 26.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.961 0.41 . . . . 0.0 111.316 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.647 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.8 t -76.72 142.22 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 29.8 p -97.85 30.52 2.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.954 0.406 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -137.72 -40.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.013 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -111.86 -16.94 13.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.133 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.8 -3.91 86.66 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.689 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' CE1' ' A' ' 569' ' ' PHE . 11.4 p -54.58 145.36 4.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.555 0.217 . . . . 0.0 111.01 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.57 140.51 51.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.94 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.8 p -148.59 178.0 9.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.569 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -75.04 174.9 8.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.394 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -63.52 -38.17 90.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.608 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -34.49 15.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.922 0.391 . . . . 0.0 111.328 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.686 ' HA ' HD12 ' A' ' 611' ' ' LEU . 7.9 m -62.67 -19.2 63.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.251 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -54.8 -34.14 62.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.982 0.42 . . . . 0.0 110.633 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.07 -35.69 15.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.396 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.5 mt -68.2 -30.09 69.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.85 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.544 HD13 ' CZ ' ' A' ' 569' ' ' PHE . 1.0 OUTLIER -58.28 151.41 19.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 -179.87 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.524 ' N ' HD23 ' A' ' 612' ' ' LEU . 11.6 p30 -80.09 127.02 31.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.858 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -83.33 147.91 27.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.155 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -176.41 39.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.867 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.958 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.778 0.323 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.3 m-70 -58.4 134.75 56.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.72 61.77 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.139 0.495 . . . . 0.0 110.034 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.729 ' HE1' HG13 ' A' ' 602' ' ' VAL . 26.0 m-85 -62.13 121.77 13.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.583 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.489 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -120.64 152.87 37.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.167 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.37 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.976 0.417 . . . . 0.0 111.25 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.496 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.11 130.01 52.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.299 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.1 m -91.98 119.97 32.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.857 0.36 . . . . 0.0 110.844 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.496 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.37 109.35 1.57 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.127 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 11.5 p -70.45 -26.05 63.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.118 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.423 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 13.9 p -139.4 161.05 59.28 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.81 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.773 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.3 Cg_exo -44.35 111.14 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.339 2.026 . . . . 0.0 112.418 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.84 ' O ' HD12 ' A' ' 587' ' ' LEU . 87.5 m -125.72 135.33 51.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 579' ' ' TYR . . . . . 0.405 ' CE1' HD13 ' A' ' 586' ' ' LEU . 25.9 m-85 -88.41 156.03 19.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.159 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.3 t -85.26 126.06 33.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -65.85 -11.41 46.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 179.802 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -91.53 -57.65 2.69 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.47 10.12 19.68 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mm-40 50.13 50.36 18.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.52 120.64 4.37 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.971 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.773 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.4 tp -46.26 131.58 10.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.874 0.369 . . . . 0.0 111.415 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -93.03 44.8 1.16 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.591 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -113.03 -165.45 0.99 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.832 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.46 -75.15 0.21 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.466 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 2.7 mp -130.42 -61.09 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.45 90.37 4.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.249 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.9 OUTLIER -53.86 -21.65 8.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.196 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.547 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 10.2 tt0 -41.23 153.36 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.808 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.65 -171.53 33.74 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.551 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 64.4 mmm -122.05 144.72 48.74 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.432 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt-85 -146.45 140.02 25.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 111.277 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.522 ' HB3' HG12 ' A' ' 602' ' ' VAL . 52.3 t -76.23 142.34 41.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.454 179.347 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.489 HG22 ' HG2' ' A' ' 570' ' ' GLU . 14.9 p -97.18 29.96 2.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.944 0.402 . . . . 0.0 110.699 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -137.98 -42.01 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.024 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.4 m -111.74 -18.4 12.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.135 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.19 -2.83 86.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.729 HG13 ' HE1' ' A' ' 569' ' ' PHE . 9.6 p -55.78 132.59 19.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 110.958 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.7 OUTLIER -115.71 140.38 49.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.989 0.423 . . . . 0.0 110.936 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.62 178.12 8.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.088 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.613 ' CD2' HD23 ' A' ' 587' ' ' LEU . 36.6 m80 -75.63 176.57 7.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.32 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.21 -37.66 88.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.626 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.48 -41.52 11.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.951 0.405 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.593 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.2 m -56.96 -21.01 26.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -53.21 -35.98 60.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.832 0.349 . . . . 0.0 110.796 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.47 -35.42 15.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.552 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.7 mt -69.84 -28.1 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.586 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.6 tt -57.8 155.56 10.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.059 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.586 ' N ' HD23 ' A' ' 612' ' ' LEU . 2.9 m-20 -79.87 132.31 36.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.762 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -89.64 146.37 24.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.93 39.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.886 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.821 0.344 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.449 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 97.2 m-70 -59.69 136.41 57.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.998 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.89 63.51 1.72 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.102 0.477 . . . . 0.0 110.041 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.495 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 30.8 m-85 -61.42 120.83 11.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.61 150.72 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.31 105.39 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.88 0.371 . . . . 0.0 111.049 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.776 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.52 129.34 51.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.48 179.859 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.5 m -95.83 117.38 30.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.907 0.384 . . . . 0.0 110.606 179.427 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.776 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.48 111.07 2.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.244 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 22.3 p -69.8 -24.09 63.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.001 0.429 . . . . 0.0 110.238 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 34.9 p -136.87 159.43 70.19 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.765 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.2 Cg_exo -46.02 112.11 0.41 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.48 2.12 . . . . 0.0 112.433 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.74 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.0 m -129.2 135.45 48.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -84.75 156.04 21.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.229 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.0 t -86.73 121.4 29.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.637 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -59.98 -17.07 35.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.234 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 582' ' ' GLU . . . . . 0.625 ' HB2' HD12 ' A' ' 612' ' ' LEU . 0.7 OUTLIER -84.85 -57.74 2.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.18 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.8 p -112.99 13.38 19.48 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.2 mt-10 46.77 49.62 14.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 111.169 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.19 124.73 5.57 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.938 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.3 tp -46.2 134.47 8.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.298 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 578' ' ' THR . 2.6 mp -94.11 39.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.55 37.34 2.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -99.15 84.8 0.65 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.364 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 27.5 mt 68.63 -69.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.678 0.275 . . . . 0.0 111.199 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -93.95 92.25 7.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.932 0.396 . . . . 0.0 111.297 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.3 OUTLIER -50.78 -23.53 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.137 179.556 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.506 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.1 OUTLIER -45.22 153.38 0.21 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 -179.942 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.14 -172.54 31.74 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.495 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 71.9 mmm -121.18 144.58 48.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.65 0.262 . . . . 0.0 110.314 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.1 ttt180 -146.68 141.21 26.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 111.197 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.522 ' HB3' HG12 ' A' ' 602' ' ' VAL . 52.6 t -76.83 144.31 39.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.478 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.6 p -98.96 30.85 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.955 0.407 . . . . 0.0 110.756 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -140.89 -40.37 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.178 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.49 -18.44 13.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.08 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.71 -5.67 84.35 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.632 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.637 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.4 p -54.69 142.63 8.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.61 0.243 . . . . 0.0 111.073 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.478 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.1 mttm -125.68 140.79 52.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.799 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -148.71 177.92 9.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.402 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 49.4 m80 -75.37 174.38 9.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.217 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 606' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -65.02 -32.91 74.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 607' ' ' LYS . . . . . 0.519 ' HG2' HD11 ' A' ' 611' ' ' LEU . 33.3 tttm -90.7 -43.85 9.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.046 0.451 . . . . 0.0 111.076 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.839 ' HA ' HD12 ' A' ' 611' ' ' LEU . 50.9 m -60.34 -24.77 65.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.429 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 609' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -57.18 -28.4 62.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.352 . . . . 0.0 110.675 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -91.08 -31.35 16.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.448 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.839 HD12 ' HA ' ' A' ' 608' ' ' CYS . 3.4 mt -77.08 -30.9 55.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.103 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.625 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.2 tt -57.22 141.49 46.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -60.5 -171.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.799 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.449 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -134.59 140.25 45.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.19 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -156.0 39.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.843 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.692 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 6.0 tt0 . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.88 0.372 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.483 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.2 m-70 -58.64 131.49 51.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.004 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -77.65 62.44 2.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 110.024 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.647 ' HE1' HG13 ' A' ' 602' ' ' VAL . 31.1 m-85 -61.48 124.53 20.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.492 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -124.12 154.01 40.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.208 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 27.9 t -62.4 105.46 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.948 0.404 . . . . 0.0 111.149 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.2 OUTLIER -122.95 134.34 54.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.313 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.5 121.18 38.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.381 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.3 109.41 2.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.131 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 5.3 p -71.05 -25.83 62.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.092 0.472 . . . . 0.0 109.995 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.429 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 6.5 p -136.42 161.09 64.11 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.782 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.575 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.71 110.48 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.504 2.136 . . . . 0.0 112.05 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.809 ' O ' HD12 ' A' ' 587' ' ' LEU . 94.8 m -124.77 136.8 54.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.182 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -86.8 156.14 20.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.523 ' O ' ' N ' ' A' ' 584' ' ' GLU . 53.2 t -89.44 119.65 30.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.57 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -59.36 -18.2 36.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.388 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 582' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 612' ' ' LEU . 0.6 OUTLIER -83.32 -57.86 3.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.131 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 31.8 p -113.48 13.57 18.89 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.1 OUTLIER 46.9 51.57 12.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.808 0.337 . . . . 0.0 111.092 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.98 123.13 4.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.952 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.575 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.14 133.81 8.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.319 . . . . 0.0 111.445 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 578' ' ' THR . 2.8 mp -94.27 43.03 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.662 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.471 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -111.86 -165.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.863 -179.778 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.83 -73.01 0.2 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.498 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 23.4 mt -133.77 -60.68 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.744 0.307 . . . . 0.0 111.114 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.88 90.27 3.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.93 0.395 . . . . 0.0 111.246 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.471 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 2.8 ptt85 -54.17 -21.46 8.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.222 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 16.8 tt0 -41.35 155.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.779 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.31 -170.14 35.06 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.584 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.435 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.9 mmm -122.28 145.99 47.71 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.429 -0.211 . . . . 0.0 110.429 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.5 ttt180 -146.53 141.87 27.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.6 t -79.12 140.41 37.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.201 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 69.7 p -97.27 30.92 2.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.005 0.431 . . . . 0.0 110.54 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -136.95 -40.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.22 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.1 m -112.37 -22.24 10.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.272 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 94.08 -5.47 72.0 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.734 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.647 HG13 ' HE1' ' A' ' 569' ' ' PHE . 11.4 p -54.5 144.55 5.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.685 0.278 . . . . 0.0 110.958 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.484 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.9 mttp -127.65 140.13 52.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.899 0.381 . . . . 0.0 110.727 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.47 177.97 9.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.023 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.479 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.2 m80 -75.06 -177.06 3.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.233 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 606' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 2.9 tt0 -73.46 -35.66 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.464 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -34.73 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.581 ' HA ' HD12 ' A' ' 611' ' ' LEU . 27.6 m -67.57 -23.8 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.372 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 609' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -59.39 -28.51 66.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.886 0.374 . . . . 0.0 110.622 179.733 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -88.79 -33.43 17.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.328 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 608' ' ' CYS . 5.9 mt -76.57 -30.16 56.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.088 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.634 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.6 tt -57.23 145.49 31.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.142 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.512 ' N ' HD23 ' A' ' 612' ' ' LEU . 2.2 m120 -62.42 -174.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.82 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.692 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -149.81 143.14 25.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.037 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -165.45 39.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.937 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 566' ' ' GLN . . . . . 0.697 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 7.7 tt0 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.459 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.9 m-70 -58.99 140.72 55.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.902 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -75.25 62.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.127 0.489 . . . . 0.0 110.094 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.476 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.8 m-85 -61.99 116.76 5.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.5 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 570' ' ' GLU . . . . . 0.506 ' CD ' HG21 ' A' ' 598' ' ' THR . 45.6 mt-10 -116.96 151.39 36.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.279 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 30.1 t -62.49 105.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 111.087 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.551 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -124.44 130.21 52.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.365 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -94.52 119.04 32.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.764 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.551 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -62.93 110.42 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.117 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 9.7 p -71.94 -26.25 62.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.092 0.472 . . . . 0.0 109.965 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 43.3 p -136.03 159.46 70.97 Favored Pre-proline 0 N--CA 1.454 -0.243 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.967 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.687 ' HB3' HD11 ' A' ' 586' ' ' LEU . 84.2 Cg_exo -45.38 111.39 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.45 2.1 . . . . 0.0 112.497 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.82 ' O ' HD12 ' A' ' 587' ' ' LEU . 92.7 m -127.28 138.39 53.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.06 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -89.01 156.09 19.08 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.061 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.496 ' O ' ' N ' ' A' ' 584' ' ' GLU . 43.2 t -88.25 122.33 31.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.611 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -61.54 -16.39 47.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.269 179.717 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -84.17 -57.62 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.3 p -116.04 16.03 16.09 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.9 mp0 45.84 52.21 9.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 111.247 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.36 122.86 4.76 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.071 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.687 HD11 ' HB3' ' A' ' 577' ' ' PRO . 16.4 tp -46.35 135.92 7.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.267 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.82 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -95.43 39.88 1.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -109.23 -167.81 1.26 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.779 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.54 -76.59 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.548 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 36.6 mt -129.95 -61.14 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.729 0.3 . . . . 0.0 111.146 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.91 90.21 4.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.41 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.8 OUTLIER -55.23 -21.42 14.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.191 179.67 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' HG23 ' A' ' 573' ' ' THR . 3.2 tt0 -42.99 153.82 0.08 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.592 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.96 -168.67 29.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.796 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.7 mmm -125.79 144.1 50.78 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 9.5 ttt180 -146.66 141.09 26.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.036 0.446 . . . . 0.0 111.57 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.52 ' HB3' HG12 ' A' ' 602' ' ' VAL . 42.5 t -79.0 144.24 34.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.228 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 598' ' ' THR . . . . . 0.506 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.8 p -99.61 32.15 2.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 0.0 110.569 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -139.25 -41.2 0.46 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.155 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.68 -17.36 13.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.49 -6.02 83.22 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.657 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.611 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.3 p -54.53 142.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.757 0.313 . . . . 0.0 111.068 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -126.12 141.45 51.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.666 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 604' ' ' CYS . . . . . 0.47 ' HB3' HD12 ' A' ' 612' ' ' LEU . 2.1 p -148.32 178.05 8.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.433 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -76.65 177.36 7.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.184 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.1 -59.32 5.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.576 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -36.48 64.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 0.0 111.597 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.8 m -57.77 -21.46 41.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.48 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -55.32 -35.43 65.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.9 0.381 . . . . 0.0 110.801 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 -35.46 18.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.72 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt -71.09 -29.43 65.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.057 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.669 HD23 ' N ' ' A' ' 613' ' ' ASN . 3.1 tt -58.28 150.86 20.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.997 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.669 ' N ' HD23 ' A' ' 612' ' ' LEU . 37.2 m-20 -72.56 128.44 35.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 614' ' ' ALA . . . . . 0.697 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -90.24 147.11 23.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.103 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -168.98 39.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.842 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.927 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.867 0.365 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' HIS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 96.7 m-70 -67.46 131.1 45.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -75.21 64.32 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.178 0.513 . . . . 0.0 109.915 179.341 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' PHE . . . . . 0.56 ' HE1' HG13 ' A' ' 602' ' ' VAL . 23.1 m-85 -61.48 125.74 24.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.675 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -128.39 153.81 46.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.219 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.38 105.41 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 0.0 111.147 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 572' ' ' TRP . . . . . 0.874 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -123.6 132.93 53.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.374 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 573' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.2 m -99.75 117.36 33.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.648 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 574' ' ' ALA . . . . . 0.874 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.82 118.25 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.319 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.5 p -77.06 -26.51 53.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.168 0.509 . . . . 0.0 110.053 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 576' ' ' THR . . . . . 0.452 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 64.1 p -131.95 157.93 76.88 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.912 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 577' ' ' PRO . . . . . 0.587 ' CB ' HD11 ' A' ' 586' ' ' LEU . 2.6 Cg_endo -45.85 111.37 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.666 2.244 . . . . 0.0 112.193 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 578' ' ' THR . . . . . 0.628 ' O ' HD12 ' A' ' 587' ' ' LEU . 33.9 m -127.61 131.91 49.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -82.99 156.09 23.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.151 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -85.68 122.12 29.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 581' ' ' TYR . . . . . 0.572 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.43 -13.96 35.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.395 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 582' ' ' GLU . . . . . 0.683 ' HB2' HD12 ' A' ' 612' ' ' LEU . 0.6 OUTLIER -89.09 -57.64 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.4 4.94 24.93 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 584' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.8 OUTLIER 53.93 48.94 20.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.57 126.09 5.6 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.949 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 586' ' ' LEU . . . . . 0.587 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.0 tp -46.31 134.42 8.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 111.234 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 587' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.53 39.62 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.802 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.32 30.15 6.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.22 81.16 1.6 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.26 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 7.9 mt 68.68 -68.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.735 0.303 . . . . 0.0 111.086 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -91.54 93.2 8.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.919 0.39 . . . . 0.0 111.134 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.1 ptt180 -51.87 -22.97 4.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.306 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 593' ' ' GLN . . . . . 0.478 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 12.0 tt0 -45.62 154.76 0.19 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.397 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.45 -163.62 21.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.699 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 595' ' ' MET . . . . . 0.462 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 69.3 mmm -126.79 144.99 50.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.353 -0.239 . . . . 0.0 110.353 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 0.2 OUTLIER -145.63 141.78 28.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.974 0.416 . . . . 0.0 111.228 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 597' ' ' CYS . . . . . 0.575 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.5 t -78.92 142.21 36.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.237 179.253 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.9 p -98.38 31.32 2.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.992 0.425 . . . . 0.0 110.564 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -139.42 -40.76 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.224 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.0 m -112.41 -21.21 11.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.253 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 92.41 -4.6 76.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.623 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 602' ' ' VAL . . . . . 0.575 HG12 ' HB3' ' A' ' 597' ' ' CYS . 8.0 p -54.41 140.84 11.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.632 0.253 . . . . 0.0 110.876 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 603' ' ' LYS . . . . . 0.455 ' HD2' ' CE2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -124.88 139.82 53.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.856 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -148.71 177.88 9.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.066 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 605' ' ' HIS . . . . . 0.578 ' CD2' HD23 ' A' ' 587' ' ' LEU . 54.3 m80 -75.86 177.73 6.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.283 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 606' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.8 tt0 -67.48 -35.23 78.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.285 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -90.85 -47.32 7.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 608' ' ' CYS . . . . . 0.528 ' HA ' HD12 ' A' ' 611' ' ' LEU . 91.0 m -59.44 -22.35 61.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.497 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 609' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.3 OUTLIER -57.8 -31.09 66.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.866 0.365 . . . . 0.0 110.434 179.746 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.28 -30.46 18.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.393 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 611' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 608' ' ' CYS . 13.9 mt -75.9 -27.97 57.88 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.133 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 612' ' ' LEU . . . . . 0.683 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.8 tt -54.5 145.49 18.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.271 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 613' ' ' ASN . . . . . 0.411 ' O ' HD23 ' A' ' 612' ' ' LEU . 2.9 m-20 -78.57 126.18 30.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -68.16 150.37 48.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.087 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -172.38 39.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.879 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.477 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 4.6 t30 . . . . . 0 C--O 1.231 0.126 0 CA-C-O 121.044 0.449 . . . . 0.0 110.132 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.727 ' CE1' HG13 ' A' ' 602' ' ' VAL . 32.7 m-85 -61.45 117.58 5.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.399 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.558 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -114.57 155.89 25.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.15 179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.33 105.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.931 0.396 . . . . 0.0 111.148 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -121.64 132.44 54.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.317 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.538 HG22 ' CD ' ' A' ' 592' ' ' ARG . 7.4 m -97.23 120.63 37.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.48 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.36 109.31 2.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.136 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 24.5 p -72.0 -25.6 61.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.443 . . . . 0.0 110.073 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 22.6 p -136.42 159.68 69.72 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.87 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.509 ' CB ' HD11 ' A' ' 586' ' ' LEU . 1.8 Cg_endo -45.28 110.5 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.555 2.17 . . . . 0.0 112.08 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.805 ' O ' HD12 ' A' ' 587' ' ' LEU . 72.1 m -127.45 137.34 52.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.052 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . 0.441 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -89.49 156.22 18.78 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.126 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -84.41 126.01 32.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.982 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.705 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.95 -13.31 56.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.136 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -57.62 2.87 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.827 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.2 p -114.87 13.52 17.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 580' ' ' CYS . 12.5 mm-40 47.96 51.26 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.7 123.52 5.26 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.027 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.509 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.0 tp -46.29 134.34 8.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.816 0.341 . . . . 0.0 111.23 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.805 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -95.04 40.74 1.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.941 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' HB2' ' CD2' ' A' ' 586' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.781 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.538 ' CD ' HG22 ' A' ' 573' ' ' THR . 0.0 OUTLIER . . . . . 0 CA--C 1.529 0.141 0 CA-C-O 120.683 0.277 . . . . 0.0 111.17 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.537 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 13.4 tt0 -42.46 158.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.663 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.44 -166.97 31.02 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.561 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 62.3 mmm -127.38 143.61 51.19 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 5.8 ttt180 -146.62 141.13 26.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.979 0.419 . . . . 0.0 111.476 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.592 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.0 t -76.85 143.1 39.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.276 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 570' ' ' GLU . 3.1 p -98.38 30.75 3.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.941 0.401 . . . . 0.0 110.765 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -139.51 -39.44 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.31 -18.89 12.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.241 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.58 -5.06 85.06 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.614 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.727 HG13 ' CE1' ' A' ' 569' ' ' PHE . 10.3 p -54.44 144.25 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.635 0.218 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.34 141.34 51.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.861 0.363 . . . . 0.0 110.981 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.7 p -148.55 178.08 8.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.417 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.1 m80 -75.59 177.13 7.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.264 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.62 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.51 -36.31 14.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.932 0.396 . . . . 0.0 111.384 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.787 ' HA ' HD12 ' A' ' 611' ' ' LEU . 18.0 m -61.55 -19.9 62.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.359 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.13 -34.07 65.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.0 -33.77 18.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.787 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.4 mt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.062 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.558 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 0.5 OUTLIER . . . . . 0 N--CA 1.457 -0.12 0 CA-C-O 121.169 0.509 . . . . 0.0 109.944 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.501 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 27.4 m-85 -61.39 117.58 5.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.639 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.498 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -118.74 150.83 39.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.099 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.52 105.39 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.974 0.416 . . . . 0.0 111.148 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.547 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.3 OUTLIER -122.44 126.81 48.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.225 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.1 m -91.38 118.09 30.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.995 0.426 . . . . 0.0 110.823 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.547 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.9 109.45 1.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.7 p -70.19 -28.74 65.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.128 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.1 p -132.94 162.52 57.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.971 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.589 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.6 Cg_endo -48.21 110.48 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.508 2.139 . . . . 0.0 111.998 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.785 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.1 m -126.33 134.19 51.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.05 156.07 21.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.121 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.49 ' O ' ' N ' ' A' ' 584' ' ' GLU . 45.2 t -86.84 123.1 31.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.843 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.646 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.22 -15.52 47.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.29 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.7 tm-20 -85.54 -57.6 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.209 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.2 p -114.67 14.23 17.53 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.49 ' N ' ' O ' ' A' ' 580' ' ' CYS . 3.6 mt-10 47.22 51.74 12.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.122 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.4 123.04 4.99 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.051 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.589 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.22 134.15 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 0.0 111.242 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.785 HD12 ' O ' ' A' ' 578' ' ' THR . 1.7 mp -94.01 39.51 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.6 ptt180 . . . . . 0 CA--C 1.528 0.115 0 CA-C-O 120.713 0.292 . . . . 0.0 111.237 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.555 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 7.1 tt0 -42.75 152.4 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.682 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.16 -172.71 32.94 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.572 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.501 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.08 145.98 47.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.556 0.217 . . . . 0.0 110.427 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 6.9 ttt180 -146.68 141.49 26.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.401 . . . . 0.0 111.223 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.558 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 51.0 t -77.71 144.12 37.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.505 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.498 HG22 ' HG2' ' A' ' 570' ' ' GLU . 16.4 p -99.18 31.3 3.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.935 0.398 . . . . 0.0 110.688 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -140.37 -40.77 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.217 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.5 m -110.44 -18.81 13.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.127 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.99 -5.22 85.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.573 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.646 HG23 ' CG ' ' A' ' 581' ' ' TYR . 15.0 p -54.57 143.93 6.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.648 0.261 . . . . 0.0 111.029 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.459 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -126.18 140.31 52.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.726 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -148.59 178.09 8.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.1 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 47.3 m80 -74.89 -176.89 3.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.285 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.2 tm-20 -72.61 -36.08 68.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.786 0.327 . . . . 0.0 111.315 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -90.68 -46.24 8.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.723 ' HA ' HD12 ' A' ' 611' ' ' LEU . 56.3 m -58.12 -24.79 60.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.356 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.2 OUTLIER -57.92 -30.61 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 110.53 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -86.61 -31.29 21.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.304 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.0 mt . . . . . 0 C--N 1.331 -0.229 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.004 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.522 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 47.7 t30 . . . . . 0 N--CA 1.456 -0.142 0 CA-C-O 121.196 0.522 . . . . 0.0 109.924 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.715 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.4 m-85 -61.12 121.86 13.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.466 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.532 ' CD ' HG21 ' A' ' 598' ' ' THR . 63.5 mt-10 -121.4 153.74 37.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.153 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.39 105.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.956 0.408 . . . . 0.0 111.201 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.476 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -122.05 130.47 53.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.185 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 18.4 m -94.77 120.62 35.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.889 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.476 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.29 109.35 1.86 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.013 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 55.4 p -68.9 -26.21 64.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.09 0.472 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 5.1 p -140.37 161.74 53.39 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.873 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.751 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.4 Cg_exo -44.05 110.78 0.22 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.414 2.076 . . . . 0.0 112.426 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.774 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.8 m -127.71 134.34 49.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -84.4 156.09 21.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.079 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.561 ' O ' ' N ' ' A' ' 584' ' ' GLU . 41.7 t -90.33 118.07 29.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.783 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -56.83 -20.36 22.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.368 179.769 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -78.11 -57.69 3.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.165 -179.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.9 p -117.71 16.28 14.46 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 580' ' ' CYS . 56.2 mt-10 46.26 52.07 10.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.753 0.311 . . . . 0.0 111.128 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.12 123.03 4.87 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.013 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.751 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.9 tp -46.3 133.24 9.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.783 0.325 . . . . 0.0 111.245 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.774 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -93.73 41.94 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.79 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.708 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.3 ptt180 . . . . . 0 CA--C 1.53 0.184 0 CA-C-O 120.651 0.262 . . . . 0.0 111.116 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 44.4 tt0 -41.41 156.15 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.716 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -170.0 -171.07 35.14 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.594 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.3 mmm -123.4 144.52 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 14.4 ttt180 -146.78 141.05 26.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.416 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.524 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.1 t -79.04 141.09 37.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.168 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.532 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.0 p -96.84 29.73 2.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.384 . . . . 0.0 110.775 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.42 -41.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.903 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.3 m -113.42 -21.04 11.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.096 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.67 3.96 76.75 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.653 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.715 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.3 p -60.83 119.4 4.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.467 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -104.85 138.76 40.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.835 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.1 p -148.66 177.94 9.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.941 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -74.14 -177.45 2.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.273 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -73.36 -33.07 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.704 0.288 . . . . 0.0 111.229 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -90.69 -33.53 15.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.743 ' HA ' HD12 ' A' ' 611' ' ' LEU . 53.0 m -68.66 -25.4 64.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.424 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.1 OUTLIER -57.18 -27.87 62.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.85 0.357 . . . . 0.0 110.684 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.26 -32.31 15.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.534 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.0 mt . . . . . 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.061 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.54 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 23.0 t30 . . . . . 0 C--O 1.231 0.099 0 CA-C-O 121.097 0.475 . . . . 0.0 109.938 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.479 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.4 m-85 -61.48 113.76 2.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -114.55 152.07 32.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.023 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.6 t -62.4 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 111.253 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.707 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.23 131.19 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.242 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -96.92 117.33 30.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.707 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.56 112.17 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.076 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 61.8 p -72.78 -29.22 63.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.054 0.455 . . . . 0.0 110.077 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.3 p -130.1 162.16 55.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.53 ' CB ' HD11 ' A' ' 586' ' ' LEU . 6.7 Cg_endo -49.19 110.44 0.36 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.46 2.107 . . . . 0.0 112.093 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.584 ' O ' HD12 ' A' ' 587' ' ' LEU . 88.7 m -126.17 140.71 52.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -92.02 156.09 17.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.258 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 584' ' ' GLU . 46.4 t -84.21 122.98 29.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.804 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.688 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -62.17 -15.08 43.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.234 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.54 -57.58 2.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -114.7 14.05 17.46 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 580' ' ' CYS . 41.7 mt-10 47.53 51.57 13.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.033 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.32 122.1 4.81 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.949 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.53 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.31 133.78 9.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.81 0.338 . . . . 0.0 111.43 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.615 HD23 ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.38 41.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.878 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.203 0 CA-C-O 120.674 0.273 . . . . 0.0 111.133 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.3 tt0 -43.56 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.666 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -168.51 -169.75 32.33 Favored Glycine 0 C--N 1.33 0.201 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.603 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.479 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 68.1 mmm -124.32 144.25 50.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 13.2 ttt180 -146.7 141.43 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.986 0.422 . . . . 0.0 111.274 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.558 ' HB3' HG12 ' A' ' 602' ' ' VAL . 49.2 t -76.96 143.81 39.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.318 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 31.31 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.403 . . . . 0.0 110.646 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -140.05 -40.39 0.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.8 m -110.23 -19.45 13.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.025 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.65 -5.76 84.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.703 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.688 HG23 ' CG ' ' A' ' 581' ' ' TYR . 13.5 p -54.45 145.82 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.613 0.244 . . . . 0.0 111.087 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -127.72 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 110.739 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.58 178.08 8.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 -179.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.615 ' CD2' HD23 ' A' ' 587' ' ' LEU . 38.6 m80 -76.94 177.94 7.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.421 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.58 -38.02 89.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.735 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -41.49 11.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.083 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.583 ' HA ' HD12 ' A' ' 611' ' ' LEU . 58.8 m -56.99 -20.97 26.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.508 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -54.65 -35.64 63.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -87.84 -33.77 18.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.47 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 608' ' ' CYS . 10.6 mt . . . . . 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.984 179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.54 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.9 t30 . . . . . 0 C--O 1.232 0.147 0 CA-C-O 121.114 0.483 . . . . 0.0 109.946 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.731 ' HE1' HG13 ' A' ' 602' ' ' VAL . 25.7 m-85 -61.52 117.3 5.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.715 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.77 154.02 31.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.997 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.35 105.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.015 0.436 . . . . 0.0 111.382 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.746 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.24 129.41 52.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.361 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.523 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.7 m -96.09 117.5 30.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.381 . . . . 0.0 110.615 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.746 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.62 111.77 2.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.234 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 23.4 p -71.85 -24.14 61.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.119 0.485 . . . . 0.0 110.162 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 4.0 p -134.99 161.16 65.34 Favored Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.016 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.548 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.33 111.15 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.614 2.209 . . . . 0.0 112.103 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 587' ' ' LEU . 44.2 m -128.68 133.75 48.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . 0.477 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.4 m-85 -85.22 156.16 21.1 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.255 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 584' ' ' GLU . 47.8 t -85.4 122.36 29.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.514 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -60.82 -16.6 42.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.387 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.38 -57.71 3.04 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.4 p -113.18 13.71 19.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.2 mm-40 47.19 51.43 13.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 111.134 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.48 125.72 5.69 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.524 -0.845 . . . . 0.0 112.969 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.548 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.3 tp -46.25 134.68 8.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.112 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 578' ' ' THR . 2.1 mp -94.55 38.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.949 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.4 OUTLIER . . . . . 0 CA--C 1.529 0.172 0 CA-C-O 120.748 0.309 . . . . 0.0 111.238 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.523 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.8 tt0 -45.89 149.99 0.6 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.387 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -161.29 -169.88 25.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.6 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.471 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 66.7 mmm -123.08 145.45 48.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.7 ttt180 -146.74 141.69 27.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.857 0.36 . . . . 0.0 111.107 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.54 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 51.5 t -78.08 143.46 37.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.409 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.2 p -98.92 31.41 2.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.601 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.95 -41.36 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.47 -22.7 10.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.999 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 89.37 7.57 69.42 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.646 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.731 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.6 p -65.05 122.38 15.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.843 0.354 . . . . 0.0 110.841 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.47 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.9 OUTLIER -105.87 139.71 40.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.935 0.398 . . . . 0.0 110.877 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.2 p -148.46 177.96 9.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.403 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 45.6 m80 -74.69 175.91 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.204 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -37.84 88.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.414 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -90.64 -37.96 13.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.897 0.38 . . . . 0.0 111.264 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.504 ' HA ' HD12 ' A' ' 611' ' ' LEU . 14.5 m -60.04 -19.65 53.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.449 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -54.74 -32.83 60.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.901 0.381 . . . . 0.0 110.639 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.66 -33.9 14.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.515 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.9 mt . . . . . 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.049 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.596 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.141 0 CA-C-O 121.178 0.513 . . . . 0.0 109.904 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.663 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.9 m-85 -65.76 123.91 21.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.605 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.586 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -124.52 149.76 46.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.167 179.537 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.5 105.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 111.31 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.85 134.91 54.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.251 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 3.4 m -96.03 121.38 37.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 110.93 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.537 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.72 109.44 3.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 45.4 p -70.1 -26.69 64.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.118 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.415 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 19.5 p -137.08 160.49 65.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.068 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.806 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.6 Cg_exo -45.33 110.9 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.327 2.018 . . . . 0.0 112.35 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 99.8 m -126.4 129.92 49.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.08 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . 0.497 ' CE1' HD13 ' A' ' 586' ' ' LEU . 29.7 m-85 -83.66 156.02 22.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.172 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.5 t -84.21 125.17 31.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.494 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.54 -12.37 43.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -89.37 -57.57 2.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.6 p -114.75 14.28 17.44 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.6 mm-40 47.74 51.46 14.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.846 0.355 . . . . 0.0 110.965 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.03 120.54 4.5 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.974 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.7 tp -46.3 134.41 8.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 111.315 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.62 39.75 1.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.763 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.801 -179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.4 ptp180 . . . . . 0 CA--C 1.529 0.148 0 CA-C-O 120.703 0.287 . . . . 0.0 111.183 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 17.3 tt0 -43.04 156.66 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.75 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -169.32 -170.37 33.79 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.465 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.52 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.91 146.26 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -146.7 140.78 26.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.063 0.459 . . . . 0.0 111.105 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.596 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 54.0 t -76.47 144.61 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.585 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.586 HG22 ' HG2' ' A' ' 570' ' ' GLU . 10.4 p -98.65 30.35 3.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.0 110.88 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -141.29 -40.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.035 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.7 m -112.39 -18.78 12.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 82.96 8.97 85.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.569 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.663 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.8 p -65.73 119.47 10.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -101.67 138.54 38.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.936 0.398 . . . . 0.0 111.001 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -148.71 178.07 8.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.026 -179.601 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.442 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.6 m80 -76.35 178.15 6.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.231 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.48 -52.09 64.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.594 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -82.46 -39.27 22.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.995 0.426 . . . . 0.0 111.223 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 90.6 m -56.76 -21.41 28.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.329 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -53.86 -41.5 67.56 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.26 -34.5 36.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.474 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 33.7 mt . . . . . 0 C--N 1.331 -0.235 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.965 179.879 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.53 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 2.6 t30 . . . . . 0 C--O 1.231 0.103 0 CA-C-O 121.097 0.475 . . . . 0.0 110.196 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.638 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.5 m-85 -61.3 119.49 8.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.418 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.498 ' CD ' HG21 ' A' ' 598' ' ' THR . 61.6 mt-10 -118.93 155.22 31.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.233 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.37 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.409 . . . . 0.0 111.139 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.477 ' CH2' ' HD2' ' A' ' 603' ' ' LYS . 0.4 OUTLIER -123.43 123.19 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.249 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.789 HG22 ' HD2' ' A' ' 592' ' ' ARG . 22.3 m -89.71 116.96 28.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.827 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.469 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -59.3 109.43 0.87 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -25.13 64.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.174 0.511 . . . . 0.0 110.058 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.435 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 12.3 p -138.42 160.63 62.93 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.737 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.516 ' CB ' HD11 ' A' ' 586' ' ' LEU . 3.8 Cg_endo -46.72 110.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.517 2.145 . . . . 0.0 112.128 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.511 HG21 ' HZ3' ' A' ' 603' ' ' LYS . 96.9 m -127.66 134.34 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -83.33 156.14 23.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.008 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -88.13 118.56 27.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.763 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.429 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -57.38 -19.94 26.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.324 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -79.51 -57.79 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -116.65 16.8 15.41 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 580' ' ' CYS . 42.2 mt-10 45.75 51.75 10.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 0.0 111.221 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.64 124.47 5.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.89 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.516 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.33 133.83 9.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.853 0.358 . . . . 0.0 111.238 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 605' ' ' HIS . 0.5 OUTLIER -94.03 39.22 1.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.479 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.816 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.789 ' HD2' HG22 ' A' ' 573' ' ' THR . 8.3 ptt180 . . . . . 0 CA--C 1.529 0.154 0 CA-C-O 120.77 0.319 . . . . 0.0 111.034 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.6 tt0 -37.83 156.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.19 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.49 -175.95 40.2 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.446 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.2 mmm -122.31 144.6 48.9 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 10.4 ttt180 -146.61 141.52 27.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.891 0.377 . . . . 0.0 111.498 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.659 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.3 t -77.27 144.38 38.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.347 179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.498 HG21 ' CD ' ' A' ' 570' ' ' GLU . 13.5 p -99.01 31.03 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.954 0.407 . . . . 0.0 110.799 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.12 -40.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.253 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.0 m -111.17 -15.12 13.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.285 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 84.42 -4.08 84.87 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.699 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.659 HG12 ' HB3' ' A' ' 597' ' ' CYS . 9.2 p -54.58 142.45 8.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.675 0.274 . . . . 0.0 111.011 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.511 ' HZ3' HG21 ' A' ' 578' ' ' THR . 1.6 mttp -127.41 139.49 52.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.797 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.5 p -148.71 177.94 9.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.15 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.523 ' HA ' HD21 ' A' ' 587' ' ' LEU . 47.5 m80 -74.1 176.74 6.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.53 78.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.458 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -90.69 -43.54 10.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.043 0.449 . . . . 0.0 111.263 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 52.7 m -55.75 -22.13 22.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.657 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -55.74 -34.79 65.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.673 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -87.59 -32.36 19.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.476 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 20.2 mt . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.979 179.876 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.586 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 4.4 t30 . . . . . 0 C--O 1.232 0.169 0 CA-C-O 121.101 0.477 . . . . 0.0 109.919 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.498 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 19.4 m-85 -64.87 120.34 12.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.666 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.469 ' HG2' HG23 ' A' ' 598' ' ' THR . 1.1 pt-20 -120.9 151.11 40.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.049 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.42 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.969 0.414 . . . . 0.0 111.238 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.777 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.22 130.69 53.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.347 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -96.68 117.47 31.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 110.835 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.777 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.31 112.37 3.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.8 p -72.25 -24.72 61.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.97 0.414 . . . . 0.0 110.256 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 21.9 p -136.39 160.19 67.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.155 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.743 ' HB3' HD11 ' A' ' 586' ' ' LEU . 85.8 Cg_exo -45.5 111.64 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.481 2.121 . . . . 0.0 112.564 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.722 ' O ' HD12 ' A' ' 587' ' ' LEU . 49.2 m -128.32 132.41 48.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -83.5 156.1 23.02 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.238 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.7 t -86.11 124.73 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.782 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -63.35 -13.87 43.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.267 179.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -88.14 -57.63 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.1 p -113.91 13.47 18.33 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 24.3 mt-10 47.78 46.48 18.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.856 0.36 . . . . 0.0 111.068 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -119.33 121.97 5.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.996 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.6 tp -46.23 135.81 7.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.816 0.341 . . . . 0.0 111.346 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.722 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -94.02 38.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.482 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.365 -179.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.482 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.529 0.145 0 CA-C-O 120.728 0.299 . . . . 0.0 111.504 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.529 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 8.8 tt0 -49.57 139.68 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.116 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -150.4 -167.77 14.74 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.675 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 74.8 mmm -120.14 146.18 46.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.603 0.239 . . . . 0.0 110.427 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.7 ttt180 -146.57 140.57 26.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.018 0.437 . . . . 0.0 111.358 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.646 ' HB3' HG12 ' A' ' 602' ' ' VAL . 54.1 t -78.86 140.5 38.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.469 HG23 ' HG2' ' A' ' 570' ' ' GLU . 80.3 p -96.8 29.24 3.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.883 0.373 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -136.73 -40.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.051 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.4 m -110.64 -12.46 14.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.17 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 78.49 5.73 87.97 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.469 -0.872 . . . . 0.0 112.739 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.646 HG12 ' HB3' ' A' ' 597' ' ' CYS . 11.7 p -65.87 145.81 13.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.577 0.227 . . . . 0.0 110.981 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.477 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.3 mttm -127.18 139.13 53.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.949 0.404 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.58 177.94 9.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.205 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.401 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 44.8 m80 -73.6 175.31 7.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.243 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.98 -37.36 87.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.672 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.43 -32.79 16.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.43 ' HA ' HD12 ' A' ' 611' ' ' LEU . 5.4 m -65.13 -19.35 65.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.472 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -53.5 -32.61 51.06 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.951 0.405 . . . . 0.0 110.65 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -93.61 -37.18 12.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.516 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 608' ' ' CYS . 12.7 mt . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.095 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.539 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 19.7 t30 . . . . . 0 C--O 1.232 0.157 0 CA-C-O 121.107 0.48 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.703 ' CE1' HG13 ' A' ' 602' ' ' VAL . 31.5 m-85 -61.44 124.24 20.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.368 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.4 ' HG3' ' CG2' ' A' ' 598' ' ' THR . 7.0 mm-40 -122.9 154.63 38.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.235 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 28.3 t -62.41 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.011 0.434 . . . . 0.0 110.925 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.799 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.6 OUTLIER -124.34 131.62 53.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.458 179.854 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 32.2 m -99.55 116.78 32.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.002 0.43 . . . . 0.0 110.678 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.799 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.32 119.05 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.205 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 19.6 p -76.04 -26.27 56.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 0.0 110.072 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 p -135.4 160.47 67.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.93 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.816 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.1 Cg_exo -45.51 111.61 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.321 2.014 . . . . 0.0 112.512 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.7 m -129.31 128.36 43.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -78.41 156.06 29.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.538 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.8 t -88.56 119.98 29.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.444 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -58.37 -18.73 29.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.332 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -80.81 -57.75 3.41 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.7 p -115.83 15.89 16.31 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 580' ' ' CYS . 43.8 mt-10 46.06 48.0 12.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 111.232 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.89 124.64 5.83 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.995 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.0 tp -46.26 133.35 9.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.362 . . . . 0.0 111.249 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.638 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.34 39.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.858 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.469 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.961 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.469 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 6.8 ptt180 . . . . . 0 CA--C 1.53 0.18 0 CA-C-O 120.689 0.281 . . . . 0.0 111.321 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 22.1 tt0 -44.98 154.29 0.15 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.465 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.02 -165.41 24.37 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.758 -0.735 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.448 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.7 mmm -127.43 143.82 51.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.414 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 10.8 ttt180 -146.54 140.49 26.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.028 0.442 . . . . 0.0 111.44 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.557 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.7 t -77.12 141.59 40.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.352 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.4 ' CG2' ' HG3' ' A' ' 570' ' ' GLU . 73.2 p -97.75 30.56 2.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.98 0.419 . . . . 0.0 110.787 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -138.33 -40.03 0.52 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.097 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.5 m -113.15 -21.13 11.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.064 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.11 0.01 78.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.625 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.703 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.1 p -58.57 126.6 16.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.966 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.6 OUTLIER -112.09 139.37 47.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.59 177.84 9.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.006 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -73.64 174.03 8.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.254 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.09 -36.93 85.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.542 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.54 -38.7 13.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 111.368 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.412 ' HA ' HD12 ' A' ' 611' ' ' LEU . 8.5 m -59.53 -20.1 53.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.55 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -55.95 -39.52 71.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.949 0.404 . . . . 0.0 110.683 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -82.51 -34.72 27.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.491 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 608' ' ' CYS . 17.8 mt . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.973 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.586 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.4 t30 . . . . . 0 N--CA 1.457 -0.113 0 CA-C-O 121.179 0.514 . . . . 0.0 110.059 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.69 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.6 m-85 -64.7 122.18 16.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.628 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.543 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -122.54 150.93 41.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.322 179.507 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.4 105.53 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.971 0.415 . . . . 0.0 111.251 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.487 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.37 132.4 53.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.272 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -94.79 121.79 36.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.005 0.431 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.487 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.23 109.42 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 33.6 p -69.11 -27.9 65.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.06 0.457 . . . . 0.0 109.933 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.424 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.8 p -135.98 162.14 58.47 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.851 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.664 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.0 Cg_endo -47.65 110.47 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.44 2.094 . . . . 0.0 112.043 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.724 ' O ' HD12 ' A' ' 587' ' ' LEU . 97.7 m -124.91 131.26 53.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -81.29 156.11 25.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.029 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -86.86 122.76 31.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.794 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.57 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -61.98 -14.6 36.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.372 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -87.99 -57.68 2.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.912 -179.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.6 p -113.22 14.15 19.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.8 mm-40 46.81 48.57 14.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 0.0 111.22 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.45 123.55 5.53 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.967 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.664 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.3 tp -46.24 134.39 8.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.866 0.365 . . . . 0.0 111.397 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.724 HD12 ' O ' ' A' ' 578' ' ' THR . 1.2 mp -93.66 40.0 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.468 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.846 -179.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.468 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt-85 . . . . . 0 CA--C 1.529 0.165 0 CA-C-O 120.677 0.275 . . . . 0.0 111.224 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 9.7 tt0 -42.41 153.6 0.07 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.711 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.42 -170.21 31.96 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.527 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.5 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.5 mmm -123.07 143.7 49.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.419 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 3.8 ttt-85 -144.76 140.96 28.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.019 0.438 . . . . 0.0 111.167 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.586 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 52.8 t -76.06 144.34 40.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.482 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.543 HG22 ' HG2' ' A' ' 570' ' ' GLU . 12.9 p -98.82 30.79 3.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -140.78 -40.69 0.41 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.027 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.63 -20.14 11.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.166 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.27 4.39 83.82 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.626 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.69 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.4 p -61.47 120.88 8.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.825 0.345 . . . . 0.0 110.837 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -105.35 138.47 41.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 111.065 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.72 177.83 9.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.806 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.406 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 47.2 m80 -73.56 -176.85 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.111 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.88 -37.04 67.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.655 0.264 . . . . 0.0 111.366 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -32.53 16.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.891 0.377 . . . . 0.0 111.262 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 611' ' ' LEU . 54.3 m -71.19 -24.79 62.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.339 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -28.01 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.96 -34.54 13.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.558 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.9 mt . . . . . 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.007 179.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.502 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 30.1 t30 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 121.028 0.442 . . . . 0.0 110.127 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.709 ' CE1' HG13 ' A' ' 602' ' ' VAL . 38.3 m-85 -61.35 113.44 2.64 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.195 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.478 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.5 OUTLIER -114.21 156.86 23.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.151 179.489 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.43 105.29 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.974 0.416 . . . . 0.0 110.938 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.905 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -121.99 133.9 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.378 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.82 HG22 ' HD3' ' A' ' 592' ' ' ARG . 6.2 m -98.72 117.52 33.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.683 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.905 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.15 114.02 5.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.176 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 56.1 p -72.97 -25.33 60.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.01 0.433 . . . . 0.0 110.169 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.7 p -134.18 159.85 70.76 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.144 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.797 ' HB3' HD11 ' A' ' 586' ' ' LEU . 89.1 Cg_exo -46.35 112.38 0.46 Allowed 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.439 2.093 . . . . 0.0 112.44 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.734 ' O ' HD12 ' A' ' 587' ' ' LEU . 42.9 m -128.35 134.18 48.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.822 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . 0.444 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -86.11 156.22 20.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.311 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.479 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.9 t -84.99 123.56 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.121 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.666 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -61.19 -15.39 33.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.365 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -88.08 -57.67 2.85 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.0 p -112.45 13.33 20.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 580' ' ' CYS . 76.1 mm-40 47.1 50.06 14.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.772 0.32 . . . . 0.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.78 124.38 5.66 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.034 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.797 HD11 ' HB3' ' A' ' 577' ' ' PRO . 17.1 tp -46.3 135.02 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.329 . . . . 0.0 111.292 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -94.67 39.12 1.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.496 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.77 -179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.82 ' HD3' HG22 ' A' ' 573' ' ' THR . 0.1 OUTLIER . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.642 0.258 . . . . 0.0 111.19 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.4 OUTLIER -40.63 159.98 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.892 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -173.1 -170.0 36.23 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.589 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 68.4 mmm -122.15 143.91 49.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt180 -146.73 142.01 27.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.913 0.387 . . . . 0.0 111.504 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.641 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.4 t -78.28 142.59 37.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.166 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.485 HG23 ' O ' ' A' ' 568' ' ' ASN . 2.6 p -98.16 30.5 3.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.916 0.388 . . . . 0.0 110.785 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -138.32 -40.26 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.217 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.8 m -111.54 -20.25 12.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.74 -4.19 81.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.615 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.709 HG13 ' CE1' ' A' ' 569' ' ' PHE . 13.7 p -54.5 145.15 4.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.608 0.242 . . . . 0.0 110.922 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.475 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.7 141.89 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.927 0.394 . . . . 0.0 110.767 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.36 178.07 8.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.046 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -76.82 178.7 6.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.27 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -66.84 -36.64 82.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.645 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -34.61 15.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.408 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.9 m -64.38 -21.82 66.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.502 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -56.3 -37.24 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 110.655 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -35.54 27.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.458 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 36.5 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 179.889 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.538 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.3 t30 . . . . . 0 C--O 1.233 0.195 0 CA-C-O 121.084 0.469 . . . . 0.0 110.028 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.485 ' CE1' HG13 ' A' ' 602' ' ' VAL . 38.6 m-85 -61.29 115.95 4.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.392 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.67 154.76 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.108 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.36 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.938 0.399 . . . . 0.0 111.265 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.751 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 1.2 t90 -122.64 129.2 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.408 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.538 HG23 ' HA ' ' A' ' 593' ' ' GLN . 19.7 m -97.87 116.95 31.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.688 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.751 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.42 119.13 9.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.165 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 29.0 p -77.15 -26.88 53.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.106 0.479 . . . . 0.0 110.118 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 17.6 p -134.44 160.8 67.09 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.944 179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.807 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.3 Cg_exo -45.36 111.09 0.29 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.399 2.066 . . . . 0.0 112.402 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 587' ' ' LEU . 56.2 m -129.83 125.01 34.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.977 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -75.28 156.04 36.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.251 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' A' ' 584' ' ' GLU . 52.3 t -86.65 120.26 27.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.807 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -57.96 -18.65 24.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.357 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -83.12 -57.74 3.15 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.08 15.04 18.4 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mp0 46.32 47.77 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 111.26 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.33 125.24 6.09 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.859 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.6 tp -46.21 133.6 9.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.872 0.368 . . . . 0.0 111.266 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.06 38.62 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.925 179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.5 ptp180 . . . . . 0 CA--C 1.528 0.13 0 CA-C-O 120.711 0.291 . . . . 0.0 111.225 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.538 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.2 tt0 -45.23 154.02 0.18 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.389 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.48 -170.37 31.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.693 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.422 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 59.7 mmm -124.38 144.69 49.89 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.5 ttt180 -146.62 142.0 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.924 0.393 . . . . 0.0 111.201 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.608 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.3 t -76.43 142.99 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.388 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 568' ' ' ASN . 18.7 p -98.83 31.39 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.965 0.412 . . . . 0.0 110.684 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -139.75 -39.72 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.114 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.1 m -111.14 -20.79 12.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.179 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 91.01 -5.12 81.85 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.596 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.619 HG23 ' CG ' ' A' ' 581' ' ' TYR . 11.6 p -54.42 142.44 8.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.602 0.239 . . . . 0.0 111.04 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.2 OUTLIER -127.02 140.45 52.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -148.61 177.9 9.09 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.45 ' HA ' HD21 ' A' ' 587' ' ' LEU . 50.4 m80 -72.82 176.03 5.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.269 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -64.38 -35.63 81.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.496 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -43.25 10.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.425 . . . . 0.0 111.222 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.814 ' HA ' HD12 ' A' ' 611' ' ' LEU . 20.1 m -55.27 -22.32 17.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.623 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -54.01 -39.46 66.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.925 0.393 . . . . 0.0 110.74 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -32.51 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.439 179.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.7 mt . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.016 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.554 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 121.053 0.454 . . . . 0.0 110.103 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.688 ' HE1' HG13 ' A' ' 602' ' ' VAL . 24.9 m-85 -66.23 122.73 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.484 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.617 ' OE1' HG21 ' A' ' 598' ' ' THR . 18.3 mt-10 -122.19 155.42 35.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.4 105.33 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.957 0.408 . . . . 0.0 111.17 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.93 129.29 51.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.295 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.7 m -96.06 117.14 30.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 0.0 110.693 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.12 110.66 2.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.056 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.1 p -69.5 -24.21 63.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.199 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.2 p -137.36 160.01 67.2 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.039 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.754 ' HB3' HD11 ' A' ' 586' ' ' LEU . 87.5 Cg_exo -46.18 111.9 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.401 2.067 . . . . 0.0 112.473 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 73.3 m -129.6 135.85 49.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.917 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -85.02 156.11 21.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.404 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.51 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.5 t -86.8 122.01 30.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.592 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -60.3 -16.51 35.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.427 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -83.98 -57.6 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 20.4 p -115.44 14.94 16.79 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 580' ' ' CYS . 6.1 mt-10 46.46 51.8 11.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.331 . . . . 0.0 111.165 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.55 123.83 5.22 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.956 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.754 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.5 tp -46.29 133.79 9.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 111.253 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.98 39.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.001 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.466 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.466 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt85 . . . . . 0 CA--C 1.529 0.137 0 CA-C-O 120.732 0.301 . . . . 0.0 111.232 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 4.4 tt0 -45.0 155.63 0.11 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.425 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.31 -167.88 26.6 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.626 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.427 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.4 mmm -126.24 143.24 51.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 7.3 ttt180 -146.69 141.43 26.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.383 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.574 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.8 t -77.15 143.16 39.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.617 HG21 ' OE1' ' A' ' 570' ' ' GLU . 28.5 p -98.46 30.61 3.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.877 0.37 . . . . 0.0 110.724 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -139.14 -40.37 0.47 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.121 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.7 m -110.37 -17.67 13.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.67 -5.0 85.77 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.67 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' HE1' ' A' ' 569' ' ' PHE . 12.4 p -54.5 142.86 7.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 O-C-N 122.734 -0.274 . . . . 0.0 111.023 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.7 mttp -126.53 140.44 52.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.857 0.361 . . . . 0.0 110.801 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.56 177.97 9.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.05 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -75.31 176.82 7.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.08 -41.85 94.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.514 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -38.76 13.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.035 0.445 . . . . 0.0 111.142 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 88.4 m -59.03 -20.52 53.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.12 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.02 -42.0 75.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.994 0.426 . . . . 0.0 110.385 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.6 -33.93 58.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.138 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 56.4 mt . . . . . 0 C--N 1.331 -0.238 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.978 179.743 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.561 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 3.8 t30 . . . . . 0 C--O 1.232 0.171 0 CA-C-O 121.092 0.472 . . . . 0.0 110.126 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.631 ' CE1' HG13 ' A' ' 602' ' ' VAL . 36.7 m-85 -61.35 114.88 3.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.323 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 598' ' ' THR . 2.7 pp20? -113.7 153.7 28.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.077 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.3 105.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 111.071 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.42 130.81 53.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.272 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -93.39 119.61 32.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.412 . . . . 0.0 110.913 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.488 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.31 109.49 1.92 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.261 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.2 p -72.12 -27.86 62.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.022 0.439 . . . . 0.0 109.982 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.44 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.7 p -133.4 162.23 58.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.911 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.528 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.5 110.45 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.413 2.075 . . . . 0.0 112.053 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.78 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.7 m -125.68 130.97 52.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.192 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 586' ' ' LEU . 28.4 m-85 -84.25 156.12 22.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.925 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.4 t -85.44 123.13 30.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.912 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -62.96 -14.09 42.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -88.99 -57.66 2.82 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.37 13.16 20.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 13.5 mt-10 47.42 51.35 13.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.27 122.81 4.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.951 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.528 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.25 134.36 8.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 111.288 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.78 HD12 ' O ' ' A' ' 578' ' ' THR . 1.3 mp -94.12 38.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.81 -179.875 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER . . . . . 0 CA--C 1.528 0.111 0 CA-C-O 120.669 0.271 . . . . 0.0 111.119 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.526 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 1.1 tt0 -43.14 154.48 0.07 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.682 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.76 -163.71 22.15 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.689 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.408 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.6 mmm -129.44 144.56 51.3 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 22.5 ttt-85 -146.65 140.48 26.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.974 0.416 . . . . 0.0 111.308 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.5 t -75.67 142.77 42.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.397 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 570' ' ' GLU . 19.4 p -98.49 30.97 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.654 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -139.37 -40.01 0.47 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.239 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.16 -20.58 12.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.56 -5.18 82.51 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.684 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.669 HG23 ' CG ' ' A' ' 581' ' ' TYR . 12.0 p -54.36 145.67 4.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 CA-C-N 116.744 0.272 . . . . 0.0 110.954 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.48 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.73 141.13 51.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.895 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.6 p -148.42 178.06 8.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.125 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -74.97 175.76 7.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.354 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -63.63 -37.7 88.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.593 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . 0.601 ' HG2' HD11 ' A' ' 611' ' ' LEU . 8.3 tttt -90.47 -40.3 12.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.952 0.406 . . . . 0.0 111.184 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.816 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.4 m -58.24 -19.87 37.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.398 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -54.97 -33.69 62.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.965 0.412 . . . . 0.0 110.606 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -90.44 -33.8 15.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.38 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.7 mt . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.04 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.589 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 4.0 t30 . . . . . 0 CA--C 1.523 -0.072 0 CA-C-O 121.113 0.482 . . . . 0.0 110.187 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.688 ' CE1' HG13 ' A' ' 602' ' ' VAL . 28.9 m-85 -66.47 115.77 6.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.292 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -114.23 155.09 26.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.113 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 33.4 t -62.37 105.21 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.952 0.406 . . . . 0.0 111.044 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.538 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.14 132.59 54.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.18 119.24 34.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.943 0.401 . . . . 0.0 110.857 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.538 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -66.08 109.48 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.094 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 1.9 p -70.78 -30.25 66.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.114 0.483 . . . . 0.0 110.017 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 1.4 p -131.64 162.98 52.93 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.952 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.602 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.1 110.54 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.465 2.11 . . . . 0.0 112.146 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.801 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.9 m -125.48 134.29 52.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -85.08 156.06 21.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.852 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.53 ' O ' ' N ' ' A' ' 584' ' ' GLU . 51.4 t -87.9 120.53 29.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.991 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.629 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -58.87 -18.08 29.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.351 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -83.02 -57.7 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.1 p -114.98 14.28 17.14 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.4 mt-10 46.97 51.45 12.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.58 123.49 5.11 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.938 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.602 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.26 131.59 10.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.85 0.357 . . . . 0.0 111.207 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.801 HD12 ' O ' ' A' ' 578' ' ' THR . 1.9 mp -93.48 42.72 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 588' ' ' TRP . 3.0 ptt180 . . . . . 0 CA--C 1.529 0.167 0 CA-C-O 120.778 0.323 . . . . 0.0 111.282 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.1 tt0 -45.02 152.6 0.23 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.695 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.71 -158.92 10.68 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.423 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 63.9 mmm -131.32 144.66 51.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.46 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.0 ttt-85 -146.51 140.7 26.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.961 0.41 . . . . 0.0 111.316 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.647 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.8 t -76.72 142.22 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 29.8 p -97.85 30.52 2.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.954 0.406 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -137.72 -40.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.013 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -111.86 -16.94 13.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.133 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.8 -3.91 86.66 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.689 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' CE1' ' A' ' 569' ' ' PHE . 11.4 p -54.58 145.36 4.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.555 0.217 . . . . 0.0 111.01 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.57 140.51 51.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.94 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.8 p -148.59 178.0 9.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.569 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -75.04 174.9 8.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.394 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -63.52 -38.17 90.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.608 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -34.49 15.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.922 0.391 . . . . 0.0 111.328 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.686 ' HA ' HD12 ' A' ' 611' ' ' LEU . 7.9 m -62.67 -19.2 63.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.251 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -54.8 -34.14 62.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.982 0.42 . . . . 0.0 110.633 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.07 -35.69 15.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.396 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.5 mt . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.85 179.766 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.56 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.9 t30 . . . . . 0 C--O 1.233 0.191 0 CA-C-O 121.139 0.495 . . . . 0.0 110.034 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.729 ' HE1' HG13 ' A' ' 602' ' ' VAL . 26.0 m-85 -62.13 121.77 13.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.583 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.489 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -120.64 152.87 37.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.167 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.37 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.976 0.417 . . . . 0.0 111.25 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.496 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.11 130.01 52.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.299 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.1 m -91.98 119.97 32.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.857 0.36 . . . . 0.0 110.844 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.496 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.37 109.35 1.57 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.127 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 11.5 p -70.45 -26.05 63.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.118 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.423 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 13.9 p -139.4 161.05 59.28 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.81 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.773 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.3 Cg_exo -44.35 111.14 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.339 2.026 . . . . 0.0 112.418 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.84 ' O ' HD12 ' A' ' 587' ' ' LEU . 87.5 m -125.72 135.33 51.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . 0.405 ' CE1' HD13 ' A' ' 586' ' ' LEU . 25.9 m-85 -88.41 156.03 19.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.159 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.3 t -85.26 126.06 33.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -65.85 -11.41 46.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 179.802 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -91.53 -57.65 2.69 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.47 10.12 19.68 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mm-40 50.13 50.36 18.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.52 120.64 4.37 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.971 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.773 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.4 tp -46.26 131.58 10.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.874 0.369 . . . . 0.0 111.415 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -93.03 44.8 1.16 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.591 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.832 -179.825 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.9 OUTLIER . . . . . 0 C--O 1.232 0.133 0 CA-C-O 120.669 0.271 . . . . 0.0 111.196 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.547 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 10.2 tt0 -41.23 153.36 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.808 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.65 -171.53 33.74 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.551 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 64.4 mmm -122.05 144.72 48.74 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.432 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt-85 -146.45 140.02 25.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 111.277 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.56 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 52.3 t -76.23 142.34 41.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.454 179.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.489 HG22 ' HG2' ' A' ' 570' ' ' GLU . 14.9 p -97.18 29.96 2.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.944 0.402 . . . . 0.0 110.699 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -137.98 -42.01 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.024 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.4 m -111.74 -18.4 12.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.135 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.19 -2.83 86.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.729 HG13 ' HE1' ' A' ' 569' ' ' PHE . 9.6 p -55.78 132.59 19.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 110.958 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.7 OUTLIER -115.71 140.38 49.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.989 0.423 . . . . 0.0 110.936 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.62 178.12 8.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.088 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.613 ' CD2' HD23 ' A' ' 587' ' ' LEU . 36.6 m80 -75.63 176.57 7.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.32 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.21 -37.66 88.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.626 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.48 -41.52 11.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.951 0.405 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.593 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.2 m -56.96 -21.01 26.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -53.21 -35.98 60.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.832 0.349 . . . . 0.0 110.796 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.47 -35.42 15.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.552 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.7 mt . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.544 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.168 0 CA-C-O 121.102 0.477 . . . . 0.0 110.041 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.495 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 30.8 m-85 -61.42 120.83 11.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.61 150.72 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.31 105.39 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.88 0.371 . . . . 0.0 111.049 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.776 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.52 129.34 51.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.48 179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.5 m -95.83 117.38 30.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.907 0.384 . . . . 0.0 110.606 179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.776 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.48 111.07 2.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.244 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 22.3 p -69.8 -24.09 63.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.001 0.429 . . . . 0.0 110.238 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 34.9 p -136.87 159.43 70.19 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.765 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.2 Cg_exo -46.02 112.11 0.41 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.48 2.12 . . . . 0.0 112.433 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.74 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.0 m -129.2 135.45 48.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -84.75 156.04 21.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.229 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.0 t -86.73 121.4 29.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.637 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -59.98 -17.07 35.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.234 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -84.85 -57.74 2.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.18 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.8 p -112.99 13.38 19.48 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.2 mt-10 46.77 49.62 14.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 111.169 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.19 124.73 5.57 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.938 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.3 tp -46.2 134.47 8.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.298 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 578' ' ' THR . 2.6 mp -94.11 39.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 -179.914 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.3 OUTLIER . . . . . 0 N--CA 1.462 0.141 0 CA-C-O 120.696 0.284 . . . . 0.0 111.137 . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.506 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.1 OUTLIER -45.22 153.38 0.21 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 -179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.14 -172.54 31.74 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.495 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 71.9 mmm -121.18 144.58 48.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.65 0.262 . . . . 0.0 110.314 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.1 ttt180 -146.68 141.21 26.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 111.197 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.544 ' HG ' ' N ' ' A' ' 568' ' ' ASN . 52.6 t -76.83 144.31 39.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.478 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.6 p -98.96 30.85 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.955 0.407 . . . . 0.0 110.756 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -140.89 -40.37 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.178 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.49 -18.44 13.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.08 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.71 -5.67 84.35 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.632 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.637 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.4 p -54.69 142.63 8.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.61 0.243 . . . . 0.0 111.073 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.478 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.1 mttm -125.68 140.79 52.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.799 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -148.71 177.92 9.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.402 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 49.4 m80 -75.37 174.38 9.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.217 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -65.02 -32.91 74.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . 0.519 ' HG2' HD11 ' A' ' 611' ' ' LEU . 33.3 tttm -90.7 -43.85 9.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.046 0.451 . . . . 0.0 111.076 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.839 ' HA ' HD12 ' A' ' 611' ' ' LEU . 50.9 m -60.34 -24.77 65.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.429 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -57.18 -28.4 62.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.352 . . . . 0.0 110.675 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -91.08 -31.35 16.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.448 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.839 HD12 ' HA ' ' A' ' 608' ' ' CYS . 3.4 mt . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.103 -179.947 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.552 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 5.0 t30 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 121.074 0.464 . . . . 0.0 110.024 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.647 ' HE1' HG13 ' A' ' 602' ' ' VAL . 31.1 m-85 -61.48 124.53 20.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.492 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -124.12 154.01 40.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.208 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 27.9 t -62.4 105.46 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.948 0.404 . . . . 0.0 111.149 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.2 OUTLIER -122.95 134.34 54.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.313 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.5 121.18 38.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.381 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.3 109.41 2.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.131 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 5.3 p -71.05 -25.83 62.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.092 0.472 . . . . 0.0 109.995 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.429 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 6.5 p -136.42 161.09 64.11 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.782 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.575 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.71 110.48 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.504 2.136 . . . . 0.0 112.05 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.809 ' O ' HD12 ' A' ' 587' ' ' LEU . 94.8 m -124.77 136.8 54.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.182 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -86.8 156.14 20.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.523 ' O ' ' N ' ' A' ' 584' ' ' GLU . 53.2 t -89.44 119.65 30.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.57 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -59.36 -18.2 36.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.388 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -83.32 -57.86 3.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.131 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 31.8 p -113.48 13.57 18.89 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.1 OUTLIER 46.9 51.57 12.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.808 0.337 . . . . 0.0 111.092 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.98 123.13 4.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.952 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.575 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.14 133.81 8.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.319 . . . . 0.0 111.445 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 578' ' ' THR . 2.8 mp -94.27 43.03 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.662 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.471 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.863 -179.778 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.471 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 2.8 ptt85 . . . . . 0 CA--C 1.529 0.151 0 CA-C-O 120.673 0.273 . . . . 0.0 111.222 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 16.8 tt0 -41.35 155.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.779 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.31 -170.14 35.06 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.584 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.435 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.9 mmm -122.28 145.99 47.71 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.429 -0.211 . . . . 0.0 110.429 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.5 ttt180 -146.53 141.87 27.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.6 t -79.12 140.41 37.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.201 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 69.7 p -97.27 30.92 2.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.005 0.431 . . . . 0.0 110.54 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -136.95 -40.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.22 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.1 m -112.37 -22.24 10.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.272 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 94.08 -5.47 72.0 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.734 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.647 HG13 ' HE1' ' A' ' 569' ' ' PHE . 11.4 p -54.5 144.55 5.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.685 0.278 . . . . 0.0 110.958 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.484 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.9 mttp -127.65 140.13 52.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.899 0.381 . . . . 0.0 110.727 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.47 177.97 9.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.023 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.479 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.2 m80 -75.06 -177.06 3.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.233 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 2.9 tt0 -73.46 -35.66 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.464 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -34.73 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.581 ' HA ' HD12 ' A' ' 611' ' ' LEU . 27.6 m -67.57 -23.8 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.372 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -59.39 -28.51 66.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.886 0.374 . . . . 0.0 110.622 179.733 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -88.79 -33.43 17.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.328 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 608' ' ' CYS . 5.9 mt . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.088 179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.503 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 11.6 t30 . . . . . 0 C--O 1.232 0.145 0 CA-C-O 121.127 0.489 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.476 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.8 m-85 -61.99 116.76 5.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.5 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . 0.506 ' CD ' HG21 ' A' ' 598' ' ' THR . 45.6 mt-10 -116.96 151.39 36.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.279 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 30.1 t -62.49 105.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 111.087 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.551 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -124.44 130.21 52.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.365 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -94.52 119.04 32.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.764 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.551 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -62.93 110.42 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.117 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 9.7 p -71.94 -26.25 62.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.092 0.472 . . . . 0.0 109.965 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 43.3 p -136.03 159.46 70.97 Favored Pre-proline 0 N--CA 1.454 -0.243 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.967 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.687 ' HB3' HD11 ' A' ' 586' ' ' LEU . 84.2 Cg_exo -45.38 111.39 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.45 2.1 . . . . 0.0 112.497 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.82 ' O ' HD12 ' A' ' 587' ' ' LEU . 92.7 m -127.28 138.39 53.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.06 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -89.01 156.09 19.08 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.061 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.496 ' O ' ' N ' ' A' ' 584' ' ' GLU . 43.2 t -88.25 122.33 31.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.611 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -61.54 -16.39 47.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.269 179.717 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -84.17 -57.62 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.3 p -116.04 16.03 16.09 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.9 mp0 45.84 52.21 9.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 111.247 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.36 122.86 4.76 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.071 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.687 HD11 ' HB3' ' A' ' 577' ' ' PRO . 16.4 tp -46.35 135.92 7.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.267 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.82 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -95.43 39.88 1.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.779 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.8 OUTLIER . . . . . 0 CA--C 1.529 0.153 0 CA-C-O 120.757 0.313 . . . . 0.0 111.191 . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' HG23 ' A' ' 573' ' ' THR . 3.2 tt0 -42.99 153.82 0.08 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.592 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.96 -168.67 29.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.796 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.7 mmm -125.79 144.1 50.78 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 9.5 ttt180 -146.66 141.09 26.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.036 0.446 . . . . 0.0 111.57 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.52 ' HB3' HG12 ' A' ' 602' ' ' VAL . 42.5 t -79.0 144.24 34.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.228 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . 0.506 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.8 p -99.61 32.15 2.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 0.0 110.569 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -139.25 -41.2 0.46 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.155 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.68 -17.36 13.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.49 -6.02 83.22 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.657 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.611 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.3 p -54.53 142.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.757 0.313 . . . . 0.0 111.068 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -126.12 141.45 51.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.666 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.1 p -148.32 178.05 8.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.433 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -76.65 177.36 7.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.184 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.1 -59.32 5.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.576 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -36.48 64.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 0.0 111.597 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.8 m -57.77 -21.46 41.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.48 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -55.32 -35.43 65.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.9 0.381 . . . . 0.0 110.801 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 -35.46 18.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.72 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.057 179.88 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 568' ' ' ASN . . . . . 0.55 ' N ' ' HG ' ' A' ' 597' ' ' CYS . 4.9 t30 . . . . . 0 C--O 1.231 0.114 0 CA-C-O 121.178 0.513 . . . . 0.0 109.915 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 569' ' ' PHE . . . . . 0.56 ' HE1' HG13 ' A' ' 602' ' ' VAL . 23.1 m-85 -61.48 125.74 24.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.675 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -128.39 153.81 46.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.219 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.38 105.41 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 0.0 111.147 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 572' ' ' TRP . . . . . 0.874 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -123.6 132.93 53.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.374 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 573' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.2 m -99.75 117.36 33.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.648 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 574' ' ' ALA . . . . . 0.874 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.82 118.25 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.319 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.5 p -77.06 -26.51 53.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.168 0.509 . . . . 0.0 110.053 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 576' ' ' THR . . . . . 0.452 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 64.1 p -131.95 157.93 76.88 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.912 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 577' ' ' PRO . . . . . 0.587 ' CB ' HD11 ' A' ' 586' ' ' LEU . 2.6 Cg_endo -45.85 111.37 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.666 2.244 . . . . 0.0 112.193 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 578' ' ' THR . . . . . 0.628 ' O ' HD12 ' A' ' 587' ' ' LEU . 33.9 m -127.61 131.91 49.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -82.99 156.09 23.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.151 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 580' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -85.68 122.12 29.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 581' ' ' TYR . . . . . 0.572 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.43 -13.96 35.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.395 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -89.09 -57.64 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.351 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.4 4.94 24.93 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 584' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.8 OUTLIER 53.93 48.94 20.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.57 126.09 5.6 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.949 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 586' ' ' LEU . . . . . 0.587 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.0 tp -46.31 134.42 8.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 111.234 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 587' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.53 39.62 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.802 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 -179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.1 ptt180 . . . . . 0 C--O 1.232 0.17 0 CA-C-O 120.751 0.31 . . . . 0.0 111.306 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 593' ' ' GLN . . . . . 0.478 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 34.4 tt0 -45.62 154.76 0.19 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.397 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.45 -163.62 21.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.699 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 595' ' ' MET . . . . . 0.462 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 69.3 mmm -126.79 144.99 50.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.353 -0.239 . . . . 0.0 110.353 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 0.2 OUTLIER -145.63 141.78 28.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.974 0.416 . . . . 0.0 111.228 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 597' ' ' CYS . . . . . 0.575 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.5 t -78.92 142.21 36.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.237 179.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.9 p -98.38 31.32 2.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.992 0.425 . . . . 0.0 110.564 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -139.42 -40.76 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.224 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.0 m -112.41 -21.21 11.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.253 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 92.41 -4.6 76.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.623 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 602' ' ' VAL . . . . . 0.575 HG12 ' HB3' ' A' ' 597' ' ' CYS . 8.0 p -54.41 140.84 11.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.632 0.253 . . . . 0.0 110.876 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 603' ' ' LYS . . . . . 0.455 ' HD2' ' CE2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -124.88 139.82 53.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.856 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -148.71 177.88 9.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.066 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 605' ' ' HIS . . . . . 0.578 ' CD2' HD23 ' A' ' 587' ' ' LEU . 54.3 m80 -75.86 177.73 6.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.283 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 606' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.8 tt0 -67.48 -35.23 78.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.285 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -90.85 -47.32 7.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 608' ' ' CYS . . . . . 0.528 ' HA ' HD12 ' A' ' 611' ' ' LEU . 91.0 m -59.44 -22.35 61.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.497 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 609' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.3 OUTLIER -57.8 -31.09 66.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.866 0.365 . . . . 0.0 110.434 179.746 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.28 -30.46 18.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.393 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 611' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 608' ' ' CYS . 13.9 mt . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.133 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.719 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 5.8 tt0 . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.815 0.34 . . . . 0.0 111.181 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.467 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 94.8 m-70 -65.36 130.74 44.42 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.96 -179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.6 t30 -77.68 61.96 2.48 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.132 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.727 ' CE1' HG13 ' A' ' 602' ' ' VAL . 32.7 m-85 -61.45 117.58 5.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.399 -179.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.558 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -114.57 155.89 25.65 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.822 -0.626 . . . . 0.0 110.15 179.354 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.5 t -62.33 105.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.423 0 CA-C-O 120.931 0.396 . . . . 0.0 111.148 -179.763 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.48 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -121.64 132.44 54.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.317 179.891 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.538 HG22 ' CD ' ' A' ' 592' ' ' ARG . 7.4 m -97.23 120.63 37.95 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.792 179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.48 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.36 109.31 2.23 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.136 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 24.5 p -72.0 -25.6 61.9 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.029 0.443 . . . . 0.0 110.073 179.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.441 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 22.6 p -136.42 159.68 69.72 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.87 179.38 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.509 ' CB ' HD11 ' A' ' 586' ' ' LEU . 1.8 Cg_endo -45.28 110.5 0.24 Allowed 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.555 2.17 . . . . 0.0 112.08 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.805 ' O ' HD12 ' A' ' 587' ' ' LEU . 72.1 m -127.45 137.34 52.68 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.136 -0.483 . . . . 0.0 111.052 -179.707 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . 0.441 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -89.49 156.22 18.78 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.126 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.457 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -84.41 126.01 32.85 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.065 -0.516 . . . . 0.0 110.982 179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.705 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -64.95 -13.31 56.95 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.136 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.84 -57.62 2.87 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.827 -179.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.2 p -114.87 13.52 17.14 Favored 'General case' 0 C--N 1.331 -0.207 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 -179.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.457 ' N ' ' O ' ' A' ' 580' ' ' CYS . 12.5 mm-40 47.96 51.26 14.71 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 120.831 0.348 . . . . 0.0 111.132 179.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.7 123.52 5.26 Favored Glycine 0 N--CA 1.45 -0.396 0 C-N-CA 120.654 -0.784 . . . . 0.0 113.027 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.509 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.0 tp -46.29 134.34 8.86 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.816 0.341 . . . . 0.0 111.23 179.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.805 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -95.04 40.74 1.1 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.941 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' HB2' ' CD2' ' A' ' 586' ' ' LEU . 0.0 OUTLIER -108.44 -165.06 1.0 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.781 -179.878 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.41 -76.15 0.22 Allowed Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.746 -0.74 . . . . 0.0 112.51 179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 56.9 mt -131.42 -61.49 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-O 120.775 0.321 . . . . 0.0 111.064 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.24 90.39 4.33 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.222 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.538 ' CD ' HG22 ' A' ' 573' ' ' THR . 0.0 OUTLIER -54.66 -21.31 10.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.17 179.658 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.537 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 13.4 tt0 -42.46 158.68 0.03 OUTLIER 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.663 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.44 -166.97 31.02 Favored Glycine 0 C--N 1.33 0.237 0 C-N-CA 120.875 -0.678 . . . . 0.0 112.561 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 62.3 mmm -127.38 143.61 51.19 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 110.275 -0.268 . . . . 0.0 110.275 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.436 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 5.8 ttt180 -146.62 141.13 26.58 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.979 0.419 . . . . 0.0 111.476 -179.756 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.592 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.0 t -76.85 143.1 39.94 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.276 179.12 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.558 HG22 ' HG2' ' A' ' 570' ' ' GLU . 3.1 p -98.38 30.75 3.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.941 0.401 . . . . 0.0 110.765 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 -139.51 -39.44 0.47 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.064 -0.517 . . . . 0.0 111.264 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.31 -18.89 12.82 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.241 -179.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.58 -5.06 85.06 Favored Glycine 0 N--CA 1.45 -0.41 0 C-N-CA 120.619 -0.801 . . . . 0.0 112.614 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.727 HG13 ' CE1' ' A' ' 569' ' ' PHE . 10.3 p -54.44 144.25 5.73 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.197 0 CA-C-N 116.635 0.218 . . . . 0.0 110.981 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.34 141.34 51.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.861 0.363 . . . . 0.0 110.981 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . 0.41 ' HB3' HD12 ' A' ' 612' ' ' LEU . 1.7 p -148.55 178.08 8.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.982 -179.809 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.417 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.1 m80 -75.59 177.13 7.0 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.264 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.09 -38.07 89.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.62 -179.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.51 -36.31 14.58 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.932 0.396 . . . . 0.0 111.384 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.787 ' HA ' HD12 ' A' ' 611' ' ' LEU . 18.0 m -61.55 -19.9 62.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.287 -0.415 . . . . 0.0 111.359 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.2 pt20 -56.13 -34.07 65.75 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 120.975 0.417 . . . . 0.0 110.556 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -88.0 -33.77 18.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.314 179.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.787 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.4 mt -71.28 -30.85 66.78 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.062 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.607 HD13 ' CZ ' ' A' ' 569' ' ' PHE . 0.7 OUTLIER -58.14 152.06 17.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.048 -179.896 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.54 ' N ' HD23 ' A' ' 612' ' ' LEU . 1.1 t-20 -78.23 143.16 37.35 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.777 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.719 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -100.27 149.72 23.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.195 -179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 34.8 t0 -176.48 39.65 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.882 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.093 0 CA-C-O 118.197 -0.906 . . . . 0.0 110.892 -179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.608 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.836 0.35 . . . . 0.0 111.23 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 96.2 m-70 -64.68 131.32 46.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.014 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 598' ' ' THR . 0.5 OUTLIER -75.54 64.61 1.66 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.169 0.509 . . . . 0.0 109.944 179.41 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.501 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 27.4 m-85 -61.39 117.58 5.85 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.639 -179.186 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.498 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -118.74 150.83 39.11 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.099 179.398 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.52 105.39 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.974 0.416 . . . . 0.0 111.148 -179.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.547 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.3 OUTLIER -122.44 126.81 48.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.949 -0.569 . . . . 0.0 110.225 179.641 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.555 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.1 m -91.38 118.09 30.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.995 0.426 . . . . 0.0 110.823 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.547 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.9 109.45 1.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.006 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.7 p -70.19 -28.74 65.55 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.061 0.458 . . . . 0.0 110.128 179.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.1 p -132.94 162.52 57.07 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.971 179.288 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.589 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.6 Cg_endo -48.21 110.48 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.278 0 C-N-CA 122.508 2.139 . . . . 0.0 111.998 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.785 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.1 m -126.33 134.19 51.16 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.952 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -85.05 156.07 21.25 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.121 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.49 ' O ' ' N ' ' A' ' 584' ' ' GLU . 45.2 t -86.84 123.1 31.61 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.843 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.646 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.22 -15.52 47.39 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.29 179.883 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . 0.559 ' HB2' HD12 ' A' ' 612' ' ' LEU . 14.7 tm-20 -85.54 -57.6 3.0 Favored 'General case' 0 C--N 1.331 -0.224 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.209 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.2 p -114.67 14.23 17.53 Favored 'General case' 0 N--CA 1.463 0.203 0 N-CA-C 112.103 0.408 . . . . 0.0 112.103 -179.034 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.49 ' N ' ' O ' ' A' ' 580' ' ' CYS . 3.6 mt-10 47.22 51.74 12.88 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 111.122 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.4 123.04 4.99 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.592 -0.813 . . . . 0.0 113.051 -179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.589 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.22 134.15 8.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.825 0.345 . . . . 0.0 111.242 179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.785 HD12 ' O ' ' A' ' 578' ' ' THR . 1.7 mp -94.01 39.51 1.08 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.929 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.36 -168.58 1.38 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.108 -0.496 . . . . 0.0 110.85 -179.954 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 112.72 -79.28 0.26 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.525 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 12.9 mt -127.23 -62.07 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.768 0.318 . . . . 0.0 111.114 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.05 90.19 4.08 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.306 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.6 ptt180 -53.88 -21.73 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.237 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.555 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 7.1 tt0 -42.75 152.4 0.1 Allowed 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.682 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.16 -172.71 32.94 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.821 -0.704 . . . . 0.0 112.572 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.501 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.08 145.98 47.21 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.556 0.217 . . . . 0.0 110.427 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.424 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 6.9 ttt180 -146.68 141.49 26.88 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.941 0.401 . . . . 0.0 111.223 -179.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.55 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.0 t -77.71 144.12 37.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.505 179.353 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.498 HG22 ' HG2' ' A' ' 570' ' ' GLU . 16.4 p -99.18 31.3 3.11 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.935 0.398 . . . . 0.0 110.688 179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -140.37 -40.77 0.42 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.217 -179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.5 m -110.44 -18.81 13.14 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.127 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.99 -5.22 85.16 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.548 -0.834 . . . . 0.0 112.573 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.646 HG23 ' CG ' ' A' ' 581' ' ' TYR . 15.0 p -54.57 143.93 6.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-O 120.648 0.261 . . . . 0.0 111.029 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.459 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -126.18 140.31 52.66 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.726 179.919 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.6 OUTLIER -148.59 178.09 8.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.1 -179.641 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 47.3 m80 -74.89 -176.89 3.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.285 179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . 0.411 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.2 tm-20 -72.61 -36.08 68.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.786 0.327 . . . . 0.0 111.315 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 20.4 mmtt -90.68 -46.24 8.38 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 121.127 0.489 . . . . 0.0 110.91 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.723 ' HA ' HD12 ' A' ' 611' ' ' LEU . 56.3 m -58.12 -24.79 60.04 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.356 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . 0.411 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.2 OUTLIER -57.92 -30.61 66.06 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-O 120.862 0.363 . . . . 0.0 110.53 179.714 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 51.3 m-20 -86.61 -31.29 21.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.304 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.723 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.0 mt -74.41 -32.11 62.56 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.019 -0.537 . . . . 0.0 111.004 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.559 HD12 ' HB2' ' A' ' 582' ' ' GLU . 0.8 OUTLIER -55.28 142.36 32.05 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.998 -179.873 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.9 m-20 -67.3 157.43 33.96 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.892 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.608 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -108.41 141.67 39.91 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.1 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -161.06 41.76 0.16 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.434 . . . . 0.0 110.86 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.204 -0.903 . . . . 0.0 110.933 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.536 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 120.687 0.28 . . . . 0.0 111.142 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.469 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.0 m-70 -68.72 131.22 44.81 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.989 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 47.7 t30 -79.31 63.46 3.94 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-O 121.196 0.522 . . . . 0.0 109.924 179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.715 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.4 m-85 -61.12 121.86 13.56 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.63 -0.713 . . . . 0.0 111.466 -179.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.532 ' CD ' HG21 ' A' ' 598' ' ' THR . 63.5 mt-10 -121.4 153.74 37.43 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.153 179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.39 105.25 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-O 120.956 0.408 . . . . 0.0 111.201 -179.69 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.476 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -122.05 130.47 53.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.185 179.664 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 18.4 m -94.77 120.62 35.28 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.952 0.406 . . . . 0.0 110.889 179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.476 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -64.29 109.35 1.86 Allowed 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.013 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 55.4 p -68.9 -26.21 64.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.09 0.472 . . . . 0.0 110.132 179.372 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.419 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 5.1 p -140.37 161.74 53.39 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.873 179.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.751 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.4 Cg_exo -44.05 110.78 0.22 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.414 2.076 . . . . 0.0 112.426 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.774 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.8 m -127.71 134.34 49.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.047 -179.786 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.4 m-85 -84.4 156.09 21.97 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.079 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.561 ' O ' ' N ' ' A' ' 584' ' ' GLU . 41.7 t -90.33 118.07 29.54 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.783 179.823 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.417 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -56.83 -20.36 22.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.368 179.769 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . 0.44 ' HB2' HD12 ' A' ' 612' ' ' LEU . 5.2 tm-20 -78.11 -57.69 3.66 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.225 -0.443 . . . . 0.0 112.165 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.9 p -117.71 16.28 14.46 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.98 0.363 . . . . 0.0 111.98 -179.118 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.561 ' N ' ' O ' ' A' ' 580' ' ' CYS . 56.2 mt-10 46.26 52.07 10.78 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.753 0.311 . . . . 0.0 111.128 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.12 123.03 4.87 Favored Glycine 0 N--CA 1.45 -0.419 0 C-N-CA 120.681 -0.771 . . . . 0.0 113.013 -179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.751 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.9 tp -46.3 133.24 9.71 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.783 0.325 . . . . 0.0 111.245 179.662 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.774 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -93.73 41.94 1.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.79 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -111.01 -165.91 1.03 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.708 -179.818 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . 0.557 ' O ' HD13 ' A' ' 590' ' ' ILE . . . 110.47 -74.18 0.21 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.671 -0.776 . . . . 0.0 112.509 -179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 589' ' ' GLY . 39.8 mm -132.58 -61.18 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.814 0.34 . . . . 0.0 111.127 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.68 90.29 3.98 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.261 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 12.3 ptt180 -53.6 -21.56 6.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.936 -0.575 . . . . 0.0 111.116 179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 44.4 tt0 -41.41 156.15 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.716 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -170.0 -171.07 35.14 Favored Glycine 0 C--N 1.332 0.326 0 C-N-CA 120.875 -0.679 . . . . 0.0 112.594 -180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.3 mmm -123.4 144.52 49.43 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.404 -0.221 . . . . 0.0 110.404 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 14.4 ttt180 -146.78 141.05 26.3 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.967 0.413 . . . . 0.0 111.416 -179.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.524 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.1 t -79.04 141.09 37.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.168 179.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.532 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.0 p -96.84 29.73 2.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.905 0.384 . . . . 0.0 110.775 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -136.42 -41.3 0.63 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.903 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.3 m -113.42 -21.04 11.08 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.096 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.67 3.96 76.75 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.627 -0.797 . . . . 0.0 112.653 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.715 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.3 p -60.83 119.4 4.79 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.194 0 CA-C-O 120.937 0.399 . . . . 0.0 110.942 179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.467 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -104.85 138.76 40.62 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.337 -0.392 . . . . 0.0 110.835 -179.984 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.1 p -148.66 177.94 9.07 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.071 -0.513 . . . . 0.0 110.941 -179.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 45.9 m80 -74.14 -177.45 2.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.273 179.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -73.36 -33.07 64.87 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.704 0.288 . . . . 0.0 111.229 -179.628 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 3.7 ptpt -90.69 -33.53 15.76 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.967 0.413 . . . . 0.0 111.047 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.743 ' HA ' HD12 ' A' ' 611' ' ' LEU . 53.0 m -68.66 -25.4 64.8 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.424 -179.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . 0.408 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.1 OUTLIER -57.18 -27.87 62.31 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.85 0.357 . . . . 0.0 110.684 179.832 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.26 -32.31 15.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.534 179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.743 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.0 mt -75.93 -32.81 59.74 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.053 -0.521 . . . . 0.0 111.061 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.44 HD12 ' HB2' ' A' ' 582' ' ' GLU . 0.9 OUTLIER -57.7 136.3 56.85 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.073 -179.815 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -64.68 169.0 5.39 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.12 -0.491 . . . . 0.0 110.758 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.536 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -111.95 148.04 34.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.151 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -161.1 39.67 0.15 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.847 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.3 m . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.238 -0.887 . . . . 0.0 110.841 179.983 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.787 0.327 . . . . 0.0 111.215 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.467 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.4 m-70 -58.99 134.82 57.32 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.899 -179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 23.0 t30 -76.64 63.44 2.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.061 -0.518 . . . . 0.0 109.938 179.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.479 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.4 m-85 -61.48 113.76 2.85 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.565 -179.205 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 2.4 pp20? -114.55 152.07 32.34 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.837 -0.619 . . . . 0.0 110.023 179.261 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.6 t -62.4 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 120.964 0.411 . . . . 0.0 111.253 -179.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.707 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.23 131.19 54.08 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.9 -0.591 . . . . 0.0 110.242 179.652 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.542 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -96.92 117.33 30.9 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.973 0.416 . . . . 0.0 110.824 179.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.707 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.56 112.17 3.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.076 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 61.8 p -72.78 -29.22 63.11 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.054 0.455 . . . . 0.0 110.077 179.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.431 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.3 p -130.1 162.16 55.67 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.024 179.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.53 ' CB ' HD11 ' A' ' 586' ' ' LEU . 6.7 Cg_endo -49.19 110.44 0.36 Allowed 'Trans proline' 0 C--N 1.343 0.252 0 C-N-CA 122.46 2.107 . . . . 0.0 112.093 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.584 ' O ' HD12 ' A' ' 587' ' ' LEU . 88.7 m -126.17 140.71 52.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.889 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.8 m-85 -92.02 156.09 17.66 Favored 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.258 -179.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.489 ' O ' ' N ' ' A' ' 584' ' ' GLU . 46.4 t -84.21 122.98 29.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.804 179.699 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.688 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -62.17 -15.08 43.79 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.234 179.837 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -86.54 -57.58 2.94 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -114.7 14.05 17.46 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 112.199 0.444 . . . . 0.0 112.199 -179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.489 ' N ' ' O ' ' A' ' 580' ' ' CYS . 41.7 mt-10 47.53 51.57 13.57 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 0.0 111.033 179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -123.32 122.1 4.81 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.949 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.53 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.31 133.78 9.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.81 0.338 . . . . 0.0 111.43 179.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.615 HD23 ' CD2' ' A' ' 605' ' ' HIS . 1.3 mp -94.38 41.09 1.09 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.784 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.82 -166.74 1.14 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.878 -179.841 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.68 -80.95 0.28 Allowed Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.732 -0.747 . . . . 0.0 112.551 179.92 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 6.5 mt -125.07 -61.75 1.57 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-O 120.736 0.303 . . . . 0.0 111.205 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.4 90.42 4.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.345 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.0 OUTLIER -54.09 -21.66 9.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.133 179.615 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.542 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.3 tt0 -43.56 157.2 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.666 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -168.51 -169.75 32.33 Favored Glycine 0 C--N 1.33 0.201 0 C-N-CA 120.914 -0.66 . . . . 0.0 112.603 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.479 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 68.1 mmm -124.32 144.25 50.11 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 110.223 -0.288 . . . . 0.0 110.223 179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.438 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 13.2 ttt180 -146.7 141.43 26.8 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.986 0.422 . . . . 0.0 111.274 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.558 ' HB3' HG12 ' A' ' 602' ' ' VAL . 49.2 t -76.96 143.81 39.22 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.318 179.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 32.8 p -99.02 31.31 3.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.945 0.403 . . . . 0.0 110.646 -179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -140.05 -40.39 0.44 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.163 -179.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.8 m -110.23 -19.45 13.0 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.451 -0.341 . . . . 0.0 111.025 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 88.65 -5.76 84.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.588 -0.815 . . . . 0.0 112.703 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.688 HG23 ' CG ' ' A' ' 581' ' ' TYR . 13.5 p -54.45 145.82 4.21 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.196 0 CA-C-O 120.613 0.244 . . . . 0.0 111.087 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -127.72 141.58 51.56 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.884 0.373 . . . . 0.0 110.739 179.916 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . 0.403 ' HB3' HD12 ' A' ' 612' ' ' LEU . 1.3 p -148.58 178.08 8.93 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.082 -179.575 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.615 ' CD2' HD23 ' A' ' 587' ' ' LEU . 38.6 m80 -76.94 177.94 7.32 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.421 179.38 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -64.58 -38.02 89.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.735 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.57 -41.49 11.34 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.127 0.489 . . . . 0.0 111.083 -179.654 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.583 ' HA ' HD12 ' A' ' 611' ' ' LEU . 58.8 m -56.99 -20.97 26.9 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.917 -0.583 . . . . 0.0 111.508 -179.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -54.65 -35.64 63.71 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.933 0.397 . . . . 0.0 110.625 179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -87.84 -33.77 18.46 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.47 179.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.583 HD12 ' HA ' ' A' ' 608' ' ' CYS . 10.6 mt -70.67 -30.57 67.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.984 179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.58 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.2 tt -58.63 151.93 19.69 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.109 -179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.58 ' N ' HD23 ' A' ' 612' ' ' LEU . 6.9 m-20 -61.25 -168.04 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.89 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -150.81 143.49 24.47 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.152 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -167.39 39.47 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.813 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.266 -0.873 . . . . 0.0 110.85 -179.989 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.812 0.339 . . . . 0.0 111.185 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.4 m-70 -59.06 133.85 56.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.971 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -77.45 61.55 2.27 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.117 -0.492 . . . . 0.0 109.946 179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.731 ' HE1' HG13 ' A' ' 602' ' ' VAL . 25.7 m-85 -61.52 117.3 5.55 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.715 -179.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -116.77 154.02 31.41 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.933 -0.576 . . . . 0.0 109.997 178.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.35 105.48 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.427 0 CA-C-O 121.015 0.436 . . . . 0.0 111.382 -179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.746 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.24 129.41 52.21 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.361 179.646 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.523 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.7 m -96.09 117.5 30.83 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.899 0.381 . . . . 0.0 110.615 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.746 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.62 111.77 2.88 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.234 -179.776 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 23.4 p -71.85 -24.14 61.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.119 0.485 . . . . 0.0 110.162 179.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 4.0 p -134.99 161.16 65.34 Favored Pre-proline 0 C--N 1.332 -0.173 0 CA-C-N 115.75 -0.659 . . . . 0.0 110.016 179.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.548 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.33 111.15 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.283 0 C-N-CA 122.614 2.209 . . . . 0.0 112.103 -179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.705 ' O ' HD12 ' A' ' 587' ' ' LEU . 44.2 m -128.68 133.75 48.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.917 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . 0.477 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.4 m-85 -85.22 156.16 21.1 Favored 'General case' 0 C--N 1.332 -0.196 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.255 -179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.509 ' O ' ' N ' ' A' ' 584' ' ' GLU . 47.8 t -85.4 122.36 29.44 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.873 179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.514 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -60.82 -16.6 42.78 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.387 179.857 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -84.38 -57.71 3.04 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 112.054 0.39 . . . . 0.0 112.054 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.4 p -113.18 13.71 19.3 Favored 'General case' 0 C--N 1.331 -0.219 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.509 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.2 mm-40 47.19 51.43 13.2 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.742 0.306 . . . . 0.0 111.134 179.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.48 125.72 5.69 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.524 -0.845 . . . . 0.0 112.969 -179.649 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.548 HD11 ' CB ' ' A' ' 577' ' ' PRO . 16.3 tp -46.25 134.68 8.51 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.772 0.32 . . . . 0.0 111.112 179.522 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.705 HD12 ' O ' ' A' ' 578' ' ' THR . 2.1 mp -94.55 38.88 1.1 Allowed 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.939 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.463 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.44 31.56 5.32 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.949 -179.875 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -90.27 81.54 1.38 Allowed Glycine 0 N--CA 1.45 -0.382 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.275 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 2.4 mp 68.86 -69.02 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-O 120.766 0.317 . . . . 0.0 111.16 -179.87 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -92.21 93.05 8.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.217 -179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.463 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.4 OUTLIER -51.63 -23.05 3.84 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.238 179.695 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.523 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.8 tt0 -45.89 149.99 0.6 Allowed 'General case' 0 N--CA 1.461 0.125 0 CA-C-N 116.379 -0.373 . . . . 0.0 111.387 -179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -161.29 -169.88 25.17 Favored Glycine 0 C--N 1.331 0.255 0 C-N-CA 120.825 -0.703 . . . . 0.0 112.6 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.471 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 66.7 mmm -123.08 145.45 48.55 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 110.332 -0.247 . . . . 0.0 110.332 179.873 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.401 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.7 ttt180 -146.74 141.69 27.01 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.857 0.36 . . . . 0.0 111.107 -179.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.504 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.5 t -78.08 143.46 37.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.409 179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 23.2 p -98.92 31.41 2.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.601 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -139.95 -41.36 0.43 Allowed 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.47 -22.7 10.69 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.999 -179.709 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 89.37 7.57 69.42 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.649 -0.786 . . . . 0.0 112.646 -179.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.731 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.6 p -65.05 122.38 15.87 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.843 0.354 . . . . 0.0 110.841 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.47 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.9 OUTLIER -105.87 139.71 40.02 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.935 0.398 . . . . 0.0 110.877 -179.893 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.2 p -148.46 177.96 9.01 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.932 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.403 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 45.6 m80 -74.69 175.91 7.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.204 179.486 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -63.93 -37.84 88.89 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.414 -179.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 10.1 ptmm? -90.64 -37.96 13.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.897 0.38 . . . . 0.0 111.264 -179.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.504 ' HA ' HD12 ' A' ' 611' ' ' LEU . 14.5 m -60.04 -19.65 53.91 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.449 -179.685 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -54.74 -32.83 60.32 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 120.901 0.381 . . . . 0.0 110.639 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -92.66 -33.9 14.18 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.515 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 608' ' ' CYS . 11.9 mt -70.14 -29.14 65.98 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.049 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.546 HD23 ' N ' ' A' ' 613' ' ' ASN . 0.9 OUTLIER -56.99 152.45 13.0 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.161 -179.905 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.546 ' N ' HD23 ' A' ' 612' ' ' LEU . 14.5 p-10 -80.48 118.29 21.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.75 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -66.76 143.99 56.6 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.144 -179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 55.3 t0 -170.49 59.62 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.825 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.866 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.758 0.313 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 97.2 m-70 -59.2 135.82 57.76 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.222 -0.444 . . . . 0.0 110.908 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . 0.503 ' O ' HG23 ' A' ' 598' ' ' THR . 0.9 OUTLIER -71.54 65.74 0.47 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.178 0.513 . . . . 0.0 109.904 179.499 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.663 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.9 m-85 -65.76 123.91 21.03 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.669 -0.696 . . . . 0.0 111.605 -179.141 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.586 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -124.52 149.76 46.57 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.167 179.537 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.5 105.45 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.396 0 CA-C-O 120.956 0.408 . . . . 0.0 111.31 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.537 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.85 134.91 54.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.251 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 3.4 m -96.03 121.38 37.72 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.918 0.389 . . . . 0.0 110.93 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.537 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.72 109.44 3.33 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 45.4 p -70.1 -26.69 64.1 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.05 0.453 . . . . 0.0 110.118 179.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.415 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 19.5 p -137.08 160.49 65.79 Favored Pre-proline 0 C--N 1.33 -0.259 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.068 179.38 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.806 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.6 Cg_exo -45.33 110.9 0.27 Allowed 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.327 2.018 . . . . 0.0 112.35 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 99.8 m -126.4 129.92 49.7 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.08 -179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . 0.497 ' CE1' HD13 ' A' ' 586' ' ' LEU . 29.7 m-85 -83.66 156.02 22.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.966 -0.561 . . . . 0.0 111.172 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.442 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.5 t -84.21 125.17 31.95 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.85 179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.61 ' HB3' HD11 ' A' ' 612' ' ' LEU . 0.1 OUTLIER -64.54 -12.37 43.94 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.303 179.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -89.37 -57.57 2.84 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.843 -179.386 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.6 p -114.75 14.28 17.44 Favored 'General case' 0 C--N 1.33 -0.248 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -178.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.442 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.6 mm-40 47.74 51.46 14.06 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.846 0.355 . . . . 0.0 110.965 179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.03 120.54 4.5 Favored Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.974 -179.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.806 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.7 tp -46.3 134.41 8.82 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.843 0.354 . . . . 0.0 111.315 179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.62 39.75 1.09 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.763 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -109.2 -165.69 1.04 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.801 -179.82 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.98 -80.6 0.27 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.694 -0.765 . . . . 0.0 112.455 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 47.6 mt -126.0 -61.98 1.4 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.778 0.323 . . . . 0.0 111.099 -179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.63 90.58 4.3 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.19 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.4 ptp180 -53.08 -21.84 5.27 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.183 179.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.541 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 17.3 tt0 -43.04 156.66 0.04 OUTLIER 'General case' 0 N--CA 1.462 0.172 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.75 -179.856 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -169.32 -170.37 33.79 Favored Glycine 0 C--N 1.331 0.278 0 C-N-CA 120.988 -0.625 . . . . 0.0 112.465 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.52 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 73.0 mmm -121.91 146.26 47.3 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.284 -0.265 . . . . 0.0 110.284 179.846 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . . . . . . . . . 14.4 ttt180 -146.7 140.78 26.19 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.063 0.459 . . . . 0.0 111.105 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.481 ' HB3' HG12 ' A' ' 602' ' ' VAL . 54.0 t -76.47 144.61 39.75 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.585 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.586 HG22 ' HG2' ' A' ' 570' ' ' GLU . 10.4 p -98.65 30.35 3.32 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.974 0.416 . . . . 0.0 110.88 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -141.29 -40.79 0.38 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.035 -179.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.7 m -112.39 -18.78 12.39 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.035 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 82.96 8.97 85.03 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.651 -0.785 . . . . 0.0 112.569 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.663 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.8 p -65.73 119.47 10.62 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.218 0 CA-C-O 120.882 0.372 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -101.67 138.54 38.52 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.936 0.398 . . . . 0.0 111.001 -179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . 0.507 ' HB3' HD12 ' A' ' 612' ' ' LEU . 1.0 OUTLIER -148.71 178.07 8.96 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.026 -179.601 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.442 ' CD2' HD23 ' A' ' 587' ' ' LEU . 41.6 m80 -76.35 178.15 6.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.231 -0.441 . . . . 0.0 110.231 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -62.48 -52.09 64.87 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.525 -0.307 . . . . 0.0 111.594 -179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 2.3 mtmt -82.46 -39.27 22.76 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.995 0.426 . . . . 0.0 111.223 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 90.6 m -56.76 -21.41 28.2 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.329 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 5.7 pt20 -53.86 -41.5 67.56 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.881 0.372 . . . . 0.0 110.698 179.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -80.26 -34.5 36.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.474 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 33.7 mt -69.48 -31.64 70.05 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.965 179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.75 HD23 ' N ' ' A' ' 613' ' ' ASN . 2.0 tt -59.14 154.64 15.55 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.063 -179.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.75 ' N ' HD23 ' A' ' 612' ' ' LEU . 13.1 m120 -60.72 -177.82 0.08 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.729 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -139.99 140.2 36.21 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.171 179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -157.39 39.57 0.29 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.121 -0.491 . . . . 0.0 110.818 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.7 m . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.209 -0.9 . . . . 0.0 110.865 -179.941 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.772 0.32 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.465 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.7 m-70 -59.28 130.61 47.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.982 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . 0.414 ' O ' HG23 ' A' ' 598' ' ' THR . 2.6 t30 -78.33 61.24 2.73 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.196 179.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.638 ' CE1' HG13 ' A' ' 602' ' ' VAL . 33.5 m-85 -61.3 119.49 8.57 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.418 -179.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.498 ' CD ' HG21 ' A' ' 598' ' ' THR . 61.6 mt-10 -118.93 155.22 31.69 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.233 179.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.37 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-O 120.958 0.409 . . . . 0.0 111.139 -179.707 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.477 ' CH2' ' HD2' ' A' ' 603' ' ' LYS . 0.4 OUTLIER -123.43 123.19 40.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.249 179.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.789 HG22 ' HD2' ' A' ' 592' ' ' ARG . 22.3 m -89.71 116.96 28.22 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.978 0.418 . . . . 0.0 110.827 179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.469 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -59.3 109.43 0.87 Allowed 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.146 -179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 43.5 p -69.23 -25.13 64.15 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.174 0.511 . . . . 0.0 110.058 179.256 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.435 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 12.3 p -138.42 160.63 62.93 Favored Pre-proline 0 C--N 1.331 -0.234 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.737 179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.516 ' CB ' HD11 ' A' ' 586' ' ' LEU . 3.8 Cg_endo -46.72 110.49 0.29 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.517 2.145 . . . . 0.0 112.128 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.511 HG21 ' HZ3' ' A' ' 603' ' ' LYS . 96.9 m -127.66 134.34 49.62 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.125 -179.839 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.7 m-85 -83.33 156.14 23.19 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.008 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.547 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.6 t -88.13 118.56 27.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.763 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.429 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.4 OUTLIER -57.38 -19.94 26.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.324 179.91 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.8 tm-20 -79.51 -57.79 3.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.1 p -116.65 16.8 15.41 Favored 'General case' 0 N--CA 1.464 0.23 0 N-CA-C 111.938 0.347 . . . . 0.0 111.938 -178.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.547 ' N ' ' O ' ' A' ' 580' ' ' CYS . 42.2 mt-10 45.75 51.75 10.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.892 0.377 . . . . 0.0 111.221 179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.64 124.47 5.42 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.89 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.516 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.5 tp -46.33 133.83 9.34 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.853 0.358 . . . . 0.0 111.238 179.756 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.523 HD21 ' HA ' ' A' ' 605' ' ' HIS . 0.5 OUTLIER -94.03 39.22 1.07 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.835 179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.479 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.86 160.9 15.39 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.816 -179.9 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 121.78 81.86 0.62 Allowed Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.542 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 21.2 mt 69.34 -65.76 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 120.712 0.291 . . . . 0.0 111.408 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.7 88.67 3.66 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.917 0.389 . . . . 0.0 111.597 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.789 ' HD2' HG22 ' A' ' 573' ' ' THR . 8.3 ptt180 -62.33 -18.09 60.5 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 116.002 -0.544 . . . . 0.0 111.034 179.392 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.54 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 3.6 tt0 -37.83 156.43 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.007 -0.542 . . . . 0.0 112.19 -179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.49 -175.95 40.2 Favored Glycine 0 C--N 1.331 0.279 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.446 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 61.2 mmm -122.31 144.6 48.9 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 110.24 -0.282 . . . . 0.0 110.24 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.443 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 10.4 ttt180 -146.61 141.52 27.0 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.891 0.377 . . . . 0.0 111.498 -179.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.659 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.3 t -77.27 144.38 38.2 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.347 179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.498 HG21 ' CD ' ' A' ' 570' ' ' GLU . 13.5 p -99.01 31.03 3.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.954 0.407 . . . . 0.0 110.799 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -140.12 -40.01 0.44 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.253 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.0 m -111.17 -15.12 13.74 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.285 -179.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 84.42 -4.08 84.87 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.503 -0.856 . . . . 0.0 112.699 -179.68 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.659 HG12 ' HB3' ' A' ' 597' ' ' CYS . 9.2 p -54.58 142.45 8.52 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.169 0 CA-C-O 120.675 0.274 . . . . 0.0 111.011 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.511 ' HZ3' HG21 ' A' ' 578' ' ' THR . 1.6 mttp -127.41 139.49 52.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.391 -0.368 . . . . 0.0 110.797 179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.5 p -148.71 177.94 9.08 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.15 -179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.523 ' HA ' HD21 ' A' ' 587' ' ' LEU . 47.5 m80 -74.1 176.74 6.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.39 179.355 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.77 -34.53 78.56 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.458 -179.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 5.1 mmtp -90.69 -43.54 10.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.043 0.449 . . . . 0.0 111.263 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 52.7 m -55.75 -22.13 22.43 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.657 -179.472 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -55.74 -34.79 65.49 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 120.946 0.403 . . . . 0.0 110.673 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -87.59 -32.36 19.36 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.476 179.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 20.2 mt -72.65 -31.82 65.4 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.979 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.44 HD23 ' N ' ' A' ' 613' ' ' ASN . 0.7 OUTLIER -58.66 144.46 43.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.025 -179.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.44 ' N ' HD23 ' A' ' 612' ' ' LEU . 2.2 m-20 -66.44 164.09 17.06 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.751 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -120.55 139.03 53.53 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.183 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -171.26 39.84 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.451 . . . . 0.0 110.884 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.062 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.865 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.786 0.327 . . . . 0.0 111.22 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.439 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.0 m-70 -58.92 135.1 57.47 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.88 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -72.42 63.9 0.58 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.101 0.477 . . . . 0.0 109.919 179.395 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.498 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 19.4 m-85 -64.87 120.34 12.36 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.666 -179.142 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.469 ' HG2' HG23 ' A' ' 598' ' ' THR . 1.1 pt-20 -120.9 151.11 40.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.049 179.37 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.42 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-O 120.969 0.414 . . . . 0.0 111.238 -179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.777 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.22 130.69 53.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.347 179.673 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.529 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -96.68 117.47 31.08 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 120.927 0.394 . . . . 0.0 110.835 179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.777 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.31 112.37 3.45 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.087 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.8 p -72.25 -24.72 61.41 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.97 0.414 . . . . 0.0 110.256 179.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.414 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 21.9 p -136.39 160.19 67.79 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.155 179.423 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.743 ' HB3' HD11 ' A' ' 586' ' ' LEU . 85.8 Cg_exo -45.5 111.64 0.34 Allowed 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 122.481 2.121 . . . . 0.0 112.564 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.722 ' O ' HD12 ' A' ' 587' ' ' LEU . 49.2 m -128.32 132.41 48.63 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.775 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -83.5 156.1 23.02 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.002 -0.545 . . . . 0.0 111.238 -179.649 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.7 t -86.11 124.73 32.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.782 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -63.35 -13.87 43.86 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.267 179.864 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 12.9 tm-20 -88.14 -57.63 2.86 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.3 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 21.1 p -113.91 13.47 18.33 Favored 'General case' 0 C--N 1.332 -0.19 0 N-CA-C 112.142 0.423 . . . . 0.0 112.142 -179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 24.3 mt-10 47.78 46.48 18.43 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.856 0.36 . . . . 0.0 111.068 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -119.33 121.97 5.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.736 -0.745 . . . . 0.0 112.996 -179.619 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.743 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.6 tp -46.23 135.81 7.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.816 0.341 . . . . 0.0 111.346 179.681 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.722 HD12 ' O ' ' A' ' 578' ' ' THR . 2.7 mp -94.02 38.93 1.07 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.496 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.482 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -113.55 17.9 17.98 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.365 -179.629 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -57.49 -65.39 3.59 Favored Glycine 0 N--CA 1.452 -0.251 0 C-N-CA 120.658 -0.782 . . . . 0.0 112.381 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 62.4 mt -139.98 -60.46 0.28 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-O 120.825 0.345 . . . . 0.0 110.593 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -97.78 93.06 6.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.697 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.482 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER -43.72 -27.67 0.34 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.988 -0.551 . . . . 0.0 111.504 179.963 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.529 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 8.8 tt0 -49.57 139.68 12.01 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.116 179.669 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -150.4 -167.77 14.74 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.675 -179.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.498 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 74.8 mmm -120.14 146.18 46.23 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.603 0.239 . . . . 0.0 110.427 179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.7 ttt180 -146.57 140.57 26.19 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.018 0.437 . . . . 0.0 111.358 -179.777 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.646 ' HB3' HG12 ' A' ' 602' ' ' VAL . 54.1 t -78.86 140.5 38.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.354 179.149 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.469 HG23 ' HG2' ' A' ' 570' ' ' GLU . 80.3 p -96.8 29.24 3.09 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.883 0.373 . . . . 0.0 110.845 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -136.73 -40.28 0.62 Allowed 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.051 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.4 m -110.64 -12.46 14.33 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.17 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 78.49 5.73 87.97 Favored Glycine 0 N--CA 1.45 -0.387 0 C-N-CA 120.469 -0.872 . . . . 0.0 112.739 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.646 HG12 ' HB3' ' A' ' 597' ' ' CYS . 11.7 p -65.87 145.81 13.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 CA-C-O 120.577 0.227 . . . . 0.0 110.981 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.477 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.3 mttm -127.18 139.13 53.16 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.949 0.404 . . . . 0.0 110.658 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.58 177.94 9.06 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.205 -179.788 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.401 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 44.8 m80 -73.6 175.31 7.22 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.243 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -63.98 -37.36 87.15 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.538 -0.301 . . . . 0.0 111.672 -179.384 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.43 -32.79 16.26 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.854 0.359 . . . . 0.0 111.487 -179.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.43 ' HA ' HD12 ' A' ' 611' ' ' LEU . 5.4 m -65.13 -19.35 65.94 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.472 -179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 18.1 pt20 -53.5 -32.61 51.06 Favored 'General case' 0 C--N 1.333 -0.143 0 CA-C-O 120.951 0.405 . . . . 0.0 110.65 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -93.61 -37.18 12.0 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.516 179.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' A' ' 608' ' ' CYS . 12.7 mt -66.86 -27.88 67.88 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.095 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.53 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.0 OUTLIER -56.58 151.3 13.9 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.099 -179.937 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.53 ' N ' HD23 ' A' ' 612' ' ' LEU . 82.4 m-20 -76.23 111.02 11.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.892 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -71.43 141.12 50.29 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.112 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 22.0 p30 -177.3 39.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.815 -179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.036 0 CA-C-O 118.241 -0.885 . . . . 0.0 110.899 -180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.4 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 65.9 tt0 . . . . . 0 N--CA 1.486 1.358 0 CA-C-O 120.787 0.327 . . . . 0.0 111.216 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 98.0 m-70 -59.08 134.29 56.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.927 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 19.7 t30 -77.99 61.43 2.57 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.107 0.48 . . . . 0.0 110.195 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.703 ' CE1' HG13 ' A' ' 602' ' ' VAL . 31.5 m-85 -61.44 124.24 20.07 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.368 -179.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.4 ' HG3' ' CG2' ' A' ' 598' ' ' THR . 7.0 mm-40 -122.9 154.63 38.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.235 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 28.3 t -62.41 105.36 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-O 121.011 0.434 . . . . 0.0 110.925 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.799 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.6 OUTLIER -124.34 131.62 53.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.458 179.854 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.487 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 32.2 m -99.55 116.78 32.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.002 0.43 . . . . 0.0 110.678 179.595 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.799 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.32 119.05 8.91 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.205 -179.76 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 19.6 p -76.04 -26.27 56.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.098 0.475 . . . . 0.0 110.072 179.245 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . . . . . . . . . 5.7 p -135.4 160.47 67.83 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.93 179.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.816 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.1 Cg_exo -45.51 111.61 0.34 Allowed 'Trans proline' 0 C--N 1.343 0.242 0 C-N-CA 122.321 2.014 . . . . 0.0 112.512 -179.832 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.638 ' O ' HD12 ' A' ' 587' ' ' LEU . 53.7 m -129.31 128.36 43.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.88 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.3 m-85 -78.41 156.06 29.64 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.305 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.538 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.8 t -88.56 119.98 29.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.011 -0.54 . . . . 0.0 110.763 179.808 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.444 ' CB ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -58.37 -18.73 29.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.401 -0.363 . . . . 0.0 111.332 179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.5 tm-20 -80.81 -57.75 3.41 Favored 'General case' 0 C--N 1.329 -0.289 0 N-CA-C 112.114 0.412 . . . . 0.0 112.114 -179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.7 p -115.83 15.89 16.31 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.538 ' N ' ' O ' ' A' ' 580' ' ' CYS . 43.8 mt-10 46.06 48.0 12.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.854 0.359 . . . . 0.0 111.232 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.89 124.64 5.83 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.623 -0.798 . . . . 0.0 112.995 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.816 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.0 tp -46.26 133.35 9.52 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.859 0.362 . . . . 0.0 111.249 179.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.638 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.34 39.58 1.06 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.484 . . . . 0.0 110.858 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.469 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.88 30.57 6.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.961 -179.931 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.49 80.37 1.62 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.747 -0.739 . . . . 0.0 112.219 179.77 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 5.1 mt 68.98 -68.58 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-O 120.715 0.293 . . . . 0.0 111.099 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -91.83 93.29 8.77 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.902 0.382 . . . . 0.0 111.162 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.469 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 6.8 ptt180 -51.81 -22.84 4.0 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.321 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.487 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 22.1 tt0 -44.98 154.29 0.15 Allowed 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.361 -0.382 . . . . 0.0 111.465 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.02 -165.41 24.37 Favored Glycine 0 N--CA 1.452 -0.25 0 C-N-CA 120.758 -0.735 . . . . 0.0 112.588 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.448 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.7 mmm -127.43 143.82 51.15 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.344 -0.243 . . . . 0.0 110.344 179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.414 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 10.8 ttt180 -146.54 140.49 26.18 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.028 0.442 . . . . 0.0 111.44 -179.679 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.557 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.7 t -77.12 141.59 40.13 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.352 179.127 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.4 ' CG2' ' HG3' ' A' ' 570' ' ' GLU . 73.2 p -97.75 30.56 2.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-O 120.98 0.419 . . . . 0.0 110.787 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -138.33 -40.03 0.52 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.097 -179.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.5 m -113.15 -21.13 11.18 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.064 -179.743 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.11 0.01 78.03 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.632 -0.795 . . . . 0.0 112.625 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.703 HG13 ' CE1' ' A' ' 569' ' ' PHE . 7.1 p -58.57 126.6 16.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 CA-C-O 120.808 0.337 . . . . 0.0 110.966 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.466 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.6 OUTLIER -112.09 139.37 47.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.352 -0.386 . . . . 0.0 110.789 179.879 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.4 p -148.59 177.84 9.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.006 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 51.4 m80 -73.64 174.03 8.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.254 179.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.1 mt-10 -63.09 -36.93 85.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.469 -0.332 . . . . 0.0 111.542 -179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.54 -38.7 13.02 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.945 0.402 . . . . 0.0 111.368 -179.698 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.412 ' HA ' HD12 ' A' ' 611' ' ' LEU . 8.5 m -59.53 -20.1 53.12 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.55 -179.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -55.95 -39.52 71.87 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-O 120.949 0.404 . . . . 0.0 110.683 179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -82.51 -34.72 27.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.491 179.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.412 HD12 ' HA ' ' A' ' 608' ' ' CYS . 17.8 mt -70.49 -30.99 67.92 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.973 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.543 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.0 OUTLIER -59.88 146.66 41.31 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.997 -179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.543 ' N ' HD23 ' A' ' 612' ' ' LEU . 3.2 m-20 -60.86 -171.61 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.839 179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.4 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -148.71 146.37 28.08 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.148 179.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -170.69 39.56 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.925 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.25 1.097 0 CA-C-O 118.208 -0.901 . . . . 0.0 110.902 179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.339 0 CA-C-O 120.825 0.345 . . . . 0.0 111.146 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.452 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 98.1 m-70 -59.72 134.52 57.1 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.923 179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . 0.458 ' O ' HG23 ' A' ' 598' ' ' THR . 3.4 t30 -73.01 64.61 0.72 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.179 0.514 . . . . 0.0 110.059 179.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.69 ' HE1' HG13 ' A' ' 602' ' ' VAL . 21.6 m-85 -64.7 122.18 16.27 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.639 -0.71 . . . . 0.0 111.628 -179.135 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.543 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -122.54 150.93 41.91 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.322 179.507 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.2 t -62.4 105.53 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.971 0.415 . . . . 0.0 111.251 -179.696 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.487 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.37 132.4 53.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.272 179.728 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.545 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 6.6 m -94.79 121.79 36.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.005 0.431 . . . . 0.0 110.928 179.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.487 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.23 109.42 2.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.125 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 33.6 p -69.11 -27.9 65.99 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.06 0.457 . . . . 0.0 109.933 179.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.424 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.8 p -135.98 162.14 58.47 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.851 179.267 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.664 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.0 Cg_endo -47.65 110.47 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.44 2.094 . . . . 0.0 112.043 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.724 ' O ' HD12 ' A' ' 587' ' ' LEU . 97.7 m -124.91 131.26 53.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.185 -0.461 . . . . 0.0 111.139 -179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -81.29 156.11 25.71 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.029 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.478 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -86.86 122.76 31.18 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.794 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.595 ' HB3' HD11 ' A' ' 612' ' ' LEU . 0.3 OUTLIER -61.98 -14.6 36.66 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.372 179.837 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . 0.677 ' HB2' HD12 ' A' ' 612' ' ' LEU . 1.9 tm-20 -87.99 -57.68 2.84 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.45 -0.341 . . . . 0.0 111.912 -179.334 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.6 p -113.22 14.15 19.33 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -178.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.478 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.8 mm-40 46.81 48.57 14.82 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 120.852 0.358 . . . . 0.0 111.22 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.45 123.55 5.53 Favored Glycine 0 N--CA 1.45 -0.377 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.967 -179.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.664 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.3 tp -46.24 134.39 8.71 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.866 0.365 . . . . 0.0 111.397 179.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.724 HD12 ' O ' ' A' ' 578' ' ' THR . 1.2 mp -93.66 40.0 1.07 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.713 179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.468 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -111.03 -166.0 1.04 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.846 -179.747 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.91 -72.93 0.21 Allowed Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.747 -0.74 . . . . 0.0 112.584 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 4.4 mp -133.85 -60.5 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-O 120.861 0.362 . . . . 0.0 111.179 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -102.88 89.91 3.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.201 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.468 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt-85 -52.84 -22.04 4.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.949 -0.568 . . . . 0.0 111.224 179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.545 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 9.7 tt0 -42.41 153.6 0.07 Allowed 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.711 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.42 -170.21 31.96 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.527 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.5 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.5 mmm -123.07 143.7 49.79 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.32 -0.252 . . . . 0.0 110.32 179.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.419 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 3.8 ttt-85 -144.76 140.96 28.85 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.019 0.438 . . . . 0.0 111.167 -179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.483 ' HB3' HG12 ' A' ' 602' ' ' VAL . 52.8 t -76.06 144.34 40.83 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.482 179.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.543 HG22 ' HG2' ' A' ' 570' ' ' GLU . 12.9 p -98.82 30.79 3.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.973 0.416 . . . . 0.0 110.818 179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -140.78 -40.69 0.41 Allowed 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.027 -179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.5 m -112.63 -20.14 11.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.367 -0.378 . . . . 0.0 111.166 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.27 4.39 83.82 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.626 -179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.69 HG13 ' HE1' ' A' ' 569' ' ' PHE . 7.4 p -61.47 120.88 8.3 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 CA-C-O 120.825 0.345 . . . . 0.0 110.837 179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -105.35 138.47 41.5 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.902 0.382 . . . . 0.0 111.065 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -148.72 177.83 9.17 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.806 179.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.406 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 47.2 m80 -73.56 -176.85 2.46 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.111 179.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -72.88 -37.04 67.46 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.655 0.264 . . . . 0.0 111.366 -179.644 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.63 -32.53 16.21 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.891 0.377 . . . . 0.0 111.262 -179.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.527 ' HA ' HD12 ' A' ' 611' ' ' LEU . 54.3 m -71.19 -24.79 62.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.339 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -56.47 -28.01 58.52 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.853 0.359 . . . . 0.0 110.68 179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -92.96 -34.54 13.72 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.558 179.557 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.527 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.9 mt -72.87 -28.14 62.32 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.007 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.677 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.0 OUTLIER -54.53 153.72 5.43 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.189 -179.907 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.456 ' N ' HD23 ' A' ' 612' ' ' LEU . 10.6 m-80 -78.69 131.41 36.61 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.937 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.452 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -80.11 142.0 35.24 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.085 179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 59.8 m-20 -154.77 38.67 0.42 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.995 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.22 -0.895 . . . . 0.0 110.903 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.371 0 CA-C-O 120.845 0.355 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.472 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 89.4 m-70 -63.38 120.64 12.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.064 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . 0.485 ' O ' HG23 ' A' ' 598' ' ' THR . 30.1 t30 -75.62 63.63 1.58 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.127 179.408 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.709 ' CE1' HG13 ' A' ' 602' ' ' VAL . 38.3 m-85 -61.35 113.44 2.64 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.856 -0.611 . . . . 0.0 111.195 -179.445 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.478 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.5 OUTLIER -114.21 156.86 23.52 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.927 -0.579 . . . . 0.0 110.151 179.489 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.43 105.29 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-O 120.974 0.416 . . . . 0.0 110.938 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.905 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -121.99 133.9 54.82 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.378 179.882 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.82 HG22 ' HD3' ' A' ' 592' ' ' ARG . 6.2 m -98.72 117.52 33.37 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.353 -0.385 . . . . 0.0 110.683 179.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.905 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -67.15 114.02 5.57 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.176 -179.791 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 56.1 p -72.97 -25.33 60.96 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.01 0.433 . . . . 0.0 110.169 179.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.7 p -134.18 159.85 70.76 Favored Pre-proline 0 C--N 1.33 -0.263 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.144 179.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.797 ' HB3' HD11 ' A' ' 586' ' ' LEU . 89.1 Cg_exo -46.35 112.38 0.46 Allowed 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.439 2.093 . . . . 0.0 112.44 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.734 ' O ' HD12 ' A' ' 587' ' ' LEU . 42.9 m -128.35 134.18 48.82 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.822 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . 0.444 ' HE1' HD13 ' A' ' 586' ' ' LEU . 3.2 m-85 -86.11 156.22 20.46 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.311 -179.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.479 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.9 t -84.99 123.56 30.68 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.98 -0.554 . . . . 0.0 111.121 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.666 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -61.19 -15.39 33.59 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.365 179.739 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -88.08 -57.67 2.85 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.078 0.399 . . . . 0.0 112.078 -179.076 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.0 p -112.45 13.33 20.17 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.479 ' N ' ' O ' ' A' ' 580' ' ' CYS . 76.1 mm-40 47.1 50.06 14.45 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.772 0.32 . . . . 0.0 111.105 179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.78 124.38 5.66 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.622 -0.799 . . . . 0.0 113.034 -179.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.797 HD11 ' HB3' ' A' ' 577' ' ' PRO . 17.1 tp -46.3 135.02 8.36 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.79 0.329 . . . . 0.0 111.292 179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -94.67 39.12 1.1 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.844 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.496 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.19 142.32 38.6 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.77 -179.988 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 139.69 87.52 0.15 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.501 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 11.2 mt 68.31 -69.13 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-O 120.723 0.297 . . . . 0.0 111.299 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.17 87.83 3.34 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.92 0.391 . . . . 0.0 111.334 -179.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.82 ' HD3' HG22 ' A' ' 573' ' ' THR . 0.1 OUTLIER -59.18 -18.9 40.48 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.011 -0.541 . . . . 0.0 111.19 179.567 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.527 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.4 OUTLIER -40.63 159.98 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.892 -179.79 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -173.1 -170.0 36.23 Favored Glycine 0 C--N 1.331 0.302 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.589 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 68.4 mmm -122.15 143.91 49.26 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 110.36 -0.237 . . . . 0.0 110.36 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.455 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt180 -146.73 142.01 27.35 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.913 0.387 . . . . 0.0 111.504 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.641 ' HB3' HG12 ' A' ' 602' ' ' VAL . 46.4 t -78.28 142.59 37.71 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.166 179.029 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.485 HG23 ' O ' ' A' ' 568' ' ' ASN . 2.6 p -98.16 30.5 3.09 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.916 0.388 . . . . 0.0 110.785 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -138.32 -40.26 0.52 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.09 -0.505 . . . . 0.0 111.217 -179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.8 m -111.54 -20.25 12.24 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.182 -179.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.74 -4.19 81.75 Favored Glycine 0 N--CA 1.45 -0.416 0 C-N-CA 120.549 -0.834 . . . . 0.0 112.615 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.709 HG13 ' CE1' ' A' ' 569' ' ' PHE . 13.7 p -54.5 145.15 4.77 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.149 0 CA-C-O 120.608 0.242 . . . . 0.0 110.922 179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.475 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.7 141.89 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.927 0.394 . . . . 0.0 110.767 179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.6 p -148.36 178.07 8.9 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.046 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 43.7 m80 -76.82 178.7 6.63 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.27 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -66.84 -36.64 82.81 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.462 -0.335 . . . . 0.0 111.645 -179.467 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -34.61 15.35 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.822 0.344 . . . . 0.0 111.408 -179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 20.9 m -64.38 -21.82 66.75 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.502 -179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -56.3 -37.24 69.62 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.961 0.41 . . . . 0.0 110.655 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -82.46 -35.54 27.4 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.458 179.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 36.5 mt -69.37 -33.17 72.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.968 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.5 137.55 58.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.887 -179.858 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -67.15 -178.14 0.76 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.788 179.877 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.402 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -126.47 140.95 52.07 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.246 -0.433 . . . . 0.0 111.072 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -165.41 53.94 0.11 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.932 -179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.848 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.786 0.327 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.488 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 94.2 m-70 -65.88 128.28 35.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.038 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . 0.406 ' O ' HG23 ' A' ' 598' ' ' THR . 3.3 t30 -78.83 63.4 3.55 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.028 179.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.488 ' CE2' ' HB2' ' A' ' 567' ' ' HIS . 38.6 m-85 -61.29 115.95 4.23 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.769 -0.651 . . . . 0.0 111.392 -179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -115.67 154.76 28.93 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.108 179.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.3 t -62.36 105.38 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 CA-C-O 120.938 0.399 . . . . 0.0 111.265 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.751 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 1.2 t90 -122.64 129.2 51.59 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.408 179.617 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.538 HG23 ' HA ' ' A' ' 593' ' ' GLN . 19.7 m -97.87 116.95 31.11 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.688 179.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.751 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -63.42 119.13 9.14 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.165 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 29.0 p -77.15 -26.88 53.54 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 121.106 0.479 . . . . 0.0 110.118 179.322 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.422 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 17.6 p -134.44 160.8 67.09 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.944 179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.807 ' HB3' HD11 ' A' ' 586' ' ' LEU . 88.3 Cg_exo -45.36 111.09 0.29 Allowed 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 122.399 2.066 . . . . 0.0 112.402 -179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.691 ' O ' HD12 ' A' ' 587' ' ' LEU . 56.2 m -129.83 125.01 34.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.977 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -75.28 156.04 36.05 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.251 -179.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.532 ' O ' ' N ' ' A' ' 584' ' ' GLU . 52.3 t -86.65 120.26 27.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.807 179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.619 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -57.96 -18.65 24.94 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 116.295 -0.412 . . . . 0.0 111.357 179.867 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -83.12 -57.74 3.15 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 112.227 0.455 . . . . 0.0 112.227 -179.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.0 p -114.08 15.04 18.4 Favored 'General case' 0 N--CA 1.463 0.197 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.532 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mp0 46.32 47.77 13.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.888 0.375 . . . . 0.0 111.26 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -121.33 125.24 6.09 Favored Glycine 0 N--CA 1.45 -0.428 0 C-N-CA 120.656 -0.783 . . . . 0.0 112.859 -179.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.807 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.6 tp -46.21 133.6 9.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.872 0.368 . . . . 0.0 111.266 179.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.691 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.06 38.62 1.08 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.839 179.958 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.35 29.91 6.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.151 -0.477 . . . . 0.0 110.925 179.937 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.75 80.41 1.59 Allowed Glycine 0 N--CA 1.45 -0.39 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.259 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 51.8 mt 69.2 -67.55 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-O 120.764 0.316 . . . . 0.0 111.173 -179.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -92.41 92.99 8.37 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.232 -179.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 1.5 ptp180 -52.77 -22.73 5.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.225 179.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.538 ' HA ' HG23 ' A' ' 573' ' ' THR . 2.2 tt0 -45.23 154.02 0.18 Allowed 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.389 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.48 -170.37 31.3 Favored Glycine 0 N--CA 1.452 -0.253 0 C-N-CA 120.789 -0.72 . . . . 0.0 112.693 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.422 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 59.7 mmm -124.38 144.69 49.89 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.445 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 8.5 ttt180 -146.62 142.0 27.48 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.924 0.393 . . . . 0.0 111.201 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.608 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.3 t -76.43 142.99 40.86 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.388 179.142 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.406 HG23 ' O ' ' A' ' 568' ' ' ASN . 18.7 p -98.83 31.39 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.965 0.412 . . . . 0.0 110.684 179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.8 mt-10 -139.75 -39.72 0.46 Allowed 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.114 -179.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 10.1 m -111.14 -20.79 12.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.179 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 91.01 -5.12 81.85 Favored Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.596 -0.811 . . . . 0.0 112.596 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.619 HG23 ' CG ' ' A' ' 581' ' ' TYR . 11.6 p -54.42 142.44 8.24 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.602 0.239 . . . . 0.0 111.04 179.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.462 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 0.2 OUTLIER -127.02 140.45 52.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.9 0.381 . . . . 0.0 110.909 179.882 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -148.61 177.9 9.09 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.922 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.45 ' HA ' HD21 ' A' ' 587' ' ' LEU . 50.4 m80 -72.82 176.03 5.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.304 -0.407 . . . . 0.0 110.269 179.403 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -64.38 -35.63 81.53 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.572 -0.286 . . . . 0.0 111.496 -179.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.67 -43.25 10.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.991 0.425 . . . . 0.0 111.222 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.814 ' HA ' HD12 ' A' ' 611' ' ' LEU . 20.1 m -55.27 -22.32 17.98 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.623 -179.615 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 11.6 pt20 -54.01 -39.46 66.13 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-O 120.925 0.393 . . . . 0.0 110.74 179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -83.61 -32.51 25.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.439 179.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.814 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.7 mt -71.04 -30.33 66.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.016 179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -59.05 133.17 55.86 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.01 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 16.7 m-20 -72.02 134.49 45.92 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.759 179.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -67.26 152.22 46.1 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.22 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -176.04 40.06 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.901 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.32 -0.848 . . . . 0.0 110.948 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.523 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 16.1 tt0 . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.753 0.311 . . . . 0.0 111.194 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.466 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 98.6 m-70 -59.61 137.98 57.86 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.948 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -75.45 62.95 1.41 Allowed 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.103 179.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.688 ' HE1' HG13 ' A' ' 602' ' ' VAL . 24.9 m-85 -66.23 122.73 18.12 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.484 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.617 ' OE1' HG21 ' A' ' 598' ' ' THR . 18.3 mt-10 -122.19 155.42 35.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.211 179.438 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.4 105.33 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.415 0 CA-C-O 120.957 0.408 . . . . 0.0 111.17 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.728 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.8 OUTLIER -122.93 129.29 51.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.295 179.771 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.513 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.7 m -96.06 117.14 30.09 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.949 0.404 . . . . 0.0 110.693 179.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.728 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.12 110.66 2.25 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.056 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 3.1 p -69.5 -24.21 63.73 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.037 0.446 . . . . 0.0 110.199 179.472 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.408 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 23.2 p -137.36 160.01 67.2 Favored Pre-proline 0 C--N 1.331 -0.205 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.039 179.38 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.754 ' HB3' HD11 ' A' ' 586' ' ' LEU . 87.5 Cg_exo -46.18 111.9 0.4 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.401 2.067 . . . . 0.0 112.473 -179.902 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.794 ' O ' HD12 ' A' ' 587' ' ' LEU . 73.3 m -129.6 135.85 49.06 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.917 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -85.02 156.11 21.25 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.964 -0.562 . . . . 0.0 111.404 -179.629 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.51 ' O ' ' N ' ' A' ' 584' ' ' GLU . 48.5 t -86.8 122.01 30.08 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.882 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.592 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -60.3 -16.51 35.14 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.427 179.951 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 11.8 tm-20 -83.98 -57.6 3.13 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 112.019 0.378 . . . . 0.0 112.019 -179.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 20.4 p -115.44 14.94 16.79 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 112.032 0.382 . . . . 0.0 112.032 -179.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.51 ' N ' ' O ' ' A' ' 580' ' ' CYS . 6.1 mt-10 46.46 51.8 11.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.796 0.331 . . . . 0.0 111.165 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.55 123.83 5.22 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.625 -0.798 . . . . 0.0 112.956 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.754 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.5 tp -46.29 133.79 9.26 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.85 0.357 . . . . 0.0 111.253 179.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.794 HD12 ' O ' ' A' ' 578' ' ' THR . 2.2 mp -93.98 39.46 1.07 Allowed 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.001 -179.961 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.466 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -107.85 35.89 2.95 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.891 -179.98 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -97.06 84.08 0.77 Allowed Glycine 0 N--CA 1.45 -0.405 0 C-N-CA 120.803 -0.713 . . . . 0.0 112.363 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 39.3 mm 68.73 -69.18 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-O 120.712 0.291 . . . . 0.0 111.213 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -93.71 92.54 7.54 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.881 0.372 . . . . 0.0 111.235 -179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.466 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 3.3 ptt85 -50.96 -23.12 2.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.232 179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.513 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 4.4 tt0 -45.0 155.63 0.11 Allowed 'General case' 0 C--O 1.232 0.136 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.425 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -165.31 -167.88 26.6 Favored Glycine 0 C--N 1.33 0.225 0 C-N-CA 120.781 -0.723 . . . . 0.0 112.626 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.427 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.4 mmm -126.24 143.24 51.22 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 110.343 -0.243 . . . . 0.0 110.343 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.44 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 7.3 ttt180 -146.69 141.43 26.81 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.974 0.416 . . . . 0.0 111.383 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.574 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.8 t -77.15 143.16 39.31 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.287 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.617 HG21 ' OE1' ' A' ' 570' ' ' GLU . 28.5 p -98.46 30.61 3.15 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.877 0.37 . . . . 0.0 110.724 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -139.14 -40.37 0.47 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.121 -179.772 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 8.7 m -110.37 -17.67 13.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.073 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.67 -5.0 85.77 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.615 -0.802 . . . . 0.0 112.67 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' HE1' ' A' ' 569' ' ' PHE . 12.4 p -54.5 142.86 7.61 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 O-C-N 122.734 -0.274 . . . . 0.0 111.023 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.472 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.7 mttp -126.53 140.44 52.45 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.857 0.361 . . . . 0.0 110.801 179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.56 177.97 9.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.05 -179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 49.8 m80 -75.31 176.82 7.06 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.333 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -65.08 -41.85 94.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.514 -179.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -90.45 -38.76 13.05 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.035 0.445 . . . . 0.0 111.142 -179.627 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 88.4 m -59.03 -20.52 53.92 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.12 -179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 9.1 pt20 -56.02 -42.0 75.8 Favored 'General case' 0 C--N 1.332 -0.156 0 CA-C-O 120.994 0.426 . . . . 0.0 110.385 179.506 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -76.6 -33.93 58.42 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.138 179.311 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 56.4 mt -71.04 -30.21 66.34 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.871 -0.604 . . . . 0.0 110.978 179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.476 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.3 tt -57.56 146.19 31.02 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.097 -179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.476 ' N ' HD23 ' A' ' 612' ' ' LEU . 5.1 p-10 -71.67 116.89 12.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.846 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.523 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -85.24 146.02 27.27 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.141 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -176.64 40.68 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.821 -179.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.049 0 CA-C-O 118.269 -0.872 . . . . 0.0 110.897 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.382 0 CA-C-O 120.862 0.363 . . . . 0.0 111.139 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.478 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 95.2 m-70 -60.3 126.56 27.96 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.066 -179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -77.8 62.66 2.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.126 179.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.631 ' CE1' HG13 ' A' ' 602' ' ' VAL . 36.7 m-85 -61.35 114.88 3.44 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.842 -0.617 . . . . 0.0 111.323 -179.353 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.402 ' HG2' HG22 ' A' ' 598' ' ' THR . 2.7 pp20? -113.7 153.7 28.53 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.91 -0.586 . . . . 0.0 110.077 179.343 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 31.2 t -62.3 105.29 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-O 120.974 0.416 . . . . 0.0 111.071 -179.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.488 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -122.42 130.81 53.47 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.272 179.825 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.526 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -93.39 119.61 32.7 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.966 0.412 . . . . 0.0 110.913 179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.488 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.31 109.49 1.92 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.261 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.2 p -72.12 -27.86 62.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.022 0.439 . . . . 0.0 109.982 179.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.44 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 2.7 p -133.4 162.23 58.92 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.911 179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.528 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.5 110.45 0.31 Allowed 'Trans proline' 0 C--N 1.344 0.303 0 C-N-CA 122.413 2.075 . . . . 0.0 112.053 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.78 ' O ' HD12 ' A' ' 587' ' ' LEU . 93.7 m -125.68 130.97 52.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.192 -179.704 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . 0.436 ' CE1' HD13 ' A' ' 586' ' ' LEU . 28.4 m-85 -84.25 156.12 22.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.925 179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.465 ' O ' ' N ' ' A' ' 584' ' ' GLU . 49.4 t -85.44 123.13 30.54 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.912 179.832 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -62.96 -14.09 42.96 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.328 179.936 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 9.9 tm-20 -88.99 -57.66 2.82 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 111.992 0.367 . . . . 0.0 111.992 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.1 p -112.37 13.16 20.26 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.465 ' N ' ' O ' ' A' ' 580' ' ' CYS . 13.5 mt-10 47.42 51.35 13.68 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.86 0.362 . . . . 0.0 111.119 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.27 122.81 4.93 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.66 -0.781 . . . . 0.0 112.951 -179.644 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.528 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.4 tp -46.25 134.36 8.76 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.822 0.344 . . . . 0.0 111.288 179.639 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.78 HD12 ' O ' ' A' ' 578' ' ' THR . 1.3 mp -94.12 38.88 1.08 Allowed 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.804 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.464 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.65 -167.89 1.28 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.81 -179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 111.78 -77.51 0.24 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.7 -0.762 . . . . 0.0 112.515 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . 0.46 ' N ' HD12 ' A' ' 590' ' ' ILE . 4.4 mp -129.28 -61.69 0.98 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.781 0.324 . . . . 0.0 111.097 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.25 90.31 4.08 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.2 -179.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.464 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.5 OUTLIER -54.15 -21.8 9.66 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.895 -0.593 . . . . 0.0 111.119 179.608 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.526 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 1.1 tt0 -43.14 154.48 0.07 Allowed 'General case' 0 N--CA 1.462 0.129 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.682 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.76 -163.71 22.15 Favored Glycine 0 C--N 1.332 0.308 0 C-N-CA 120.856 -0.688 . . . . 0.0 112.689 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.408 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 61.6 mmm -129.44 144.56 51.3 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.448 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 22.5 ttt-85 -146.65 140.48 26.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.974 0.416 . . . . 0.0 111.308 -179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.5 t -75.67 142.77 42.47 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.397 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.402 HG22 ' HG2' ' A' ' 570' ' ' GLU . 19.4 p -98.49 30.97 3.0 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.958 0.409 . . . . 0.0 110.654 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -139.37 -40.01 0.47 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.239 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.4 m -111.16 -20.58 12.3 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.506 -0.315 . . . . 0.0 111.15 -179.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 90.56 -5.18 82.51 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.594 -0.813 . . . . 0.0 112.684 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.669 HG23 ' CG ' ' A' ' 581' ' ' TYR . 12.0 p -54.36 145.67 4.23 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.114 0 CA-C-N 116.744 0.272 . . . . 0.0 110.954 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.48 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.5 OUTLIER -128.73 141.13 51.42 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.9 0.381 . . . . 0.0 110.895 179.952 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.6 p -148.42 178.06 8.92 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.125 -179.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -74.97 175.76 7.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.354 179.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -63.63 -37.7 88.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.593 -179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . 0.601 ' HG2' HD11 ' A' ' 611' ' ' LEU . 8.3 tttt -90.47 -40.3 12.1 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.952 0.406 . . . . 0.0 111.184 -179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.816 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.4 m -58.24 -19.87 37.41 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.398 -179.623 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -54.97 -33.69 62.66 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-O 120.965 0.412 . . . . 0.0 110.606 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -90.44 -33.8 15.86 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.38 179.506 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 608' ' ' CYS . 4.7 mt -71.27 -29.52 65.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.0 -0.545 . . . . 0.0 111.04 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.445 HD11 ' HB3' ' A' ' 581' ' ' TYR . 1.2 tt -58.59 144.56 42.48 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.107 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.443 ' N ' HD23 ' A' ' 612' ' ' LEU . 4.7 t-20 -65.5 -174.15 0.18 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.784 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -130.92 142.13 50.34 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.136 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -176.18 39.57 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.826 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.6 t . . . . . 0 C--O 1.249 1.043 0 CA-C-O 118.243 -0.884 . . . . 0.0 110.918 179.95 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.802 0.334 . . . . 0.0 111.175 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.484 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.4 m-70 -58.87 131.55 51.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.976 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -73.66 63.39 0.84 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.113 0.482 . . . . 0.0 110.187 179.567 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.688 ' CE1' HG13 ' A' ' 602' ' ' VAL . 28.9 m-85 -66.47 115.77 6.72 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.292 -179.423 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -114.23 155.09 26.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.113 179.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 33.4 t -62.37 105.21 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 120.952 0.406 . . . . 0.0 111.044 -179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.538 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -121.14 132.59 54.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.948 -0.569 . . . . 0.0 110.28 179.899 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.18 119.24 34.32 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.943 0.401 . . . . 0.0 110.857 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.538 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -66.08 109.48 2.6 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.094 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 1.9 p -70.78 -30.25 66.68 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.114 0.483 . . . . 0.0 110.017 179.373 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 1.4 p -131.64 162.98 52.93 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-N 115.637 -0.711 . . . . 0.0 109.952 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.602 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.8 Cg_endo -48.1 110.54 0.33 Allowed 'Trans proline' 0 C--N 1.344 0.3 0 C-N-CA 122.465 2.11 . . . . 0.0 112.146 179.834 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.801 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.9 m -125.48 134.29 52.1 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.148 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -85.08 156.06 21.24 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.852 -179.916 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.53 ' O ' ' N ' ' A' ' 584' ' ' GLU . 51.4 t -87.9 120.53 29.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.991 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.629 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -58.87 -18.08 29.72 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.351 179.85 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -83.02 -57.7 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.087 0.402 . . . . 0.0 112.087 -179.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 26.1 p -114.98 14.28 17.14 Favored 'General case' 0 C--N 1.332 -0.172 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.53 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.4 mt-10 46.97 51.45 12.8 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.83 0.348 . . . . 0.0 111.245 -179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.58 123.49 5.11 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.531 -0.843 . . . . 0.0 112.938 -179.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.602 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.26 131.59 10.36 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.85 0.357 . . . . 0.0 111.207 179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.801 HD12 ' O ' ' A' ' 578' ' ' THR . 1.9 mp -93.48 42.72 1.1 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.913 -179.989 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.473 ' CZ3' ' HB2' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.47 29.32 7.49 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.868 -179.949 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -87.3 80.47 1.71 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.376 179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 19.4 mt 69.32 -66.91 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-O 120.777 0.322 . . . . 0.0 111.185 -179.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -94.49 91.88 6.84 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.448 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.473 ' HB2' ' CZ3' ' A' ' 588' ' ' TRP . 3.0 ptt180 -49.53 -24.73 2.24 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.282 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 2.1 tt0 -45.02 152.6 0.23 Allowed 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.695 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.71 -158.92 10.68 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.913 -0.66 . . . . 0.0 112.423 179.895 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . . . . . . . . . 63.9 mmm -131.32 144.66 51.42 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 110.351 -0.241 . . . . 0.0 110.351 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.46 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.0 ttt-85 -146.51 140.7 26.38 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.961 0.41 . . . . 0.0 111.316 -179.701 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.647 ' HB3' HG12 ' A' ' 602' ' ' VAL . 51.8 t -76.72 142.22 40.56 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.946 -0.57 . . . . 0.0 110.472 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 29.8 p -97.85 30.52 2.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.954 0.406 . . . . 0.0 110.644 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.6 mm-40 -137.72 -40.93 0.55 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.013 -179.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -111.86 -16.94 13.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.133 -179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.8 -3.91 86.66 Favored Glycine 0 N--CA 1.45 -0.417 0 C-N-CA 120.498 -0.858 . . . . 0.0 112.689 -179.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.688 HG13 ' CE1' ' A' ' 569' ' ' PHE . 11.4 p -54.58 145.36 4.68 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.147 0 CA-C-O 120.555 0.217 . . . . 0.0 111.01 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.46 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 0.8 OUTLIER -128.57 140.51 51.75 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.854 0.359 . . . . 0.0 110.94 -179.901 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 2.8 p -148.59 178.0 9.0 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.1 -179.813 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.569 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -75.04 174.9 8.73 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.394 179.487 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -63.52 -38.17 90.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.608 -179.468 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.46 -34.49 15.58 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.922 0.391 . . . . 0.0 111.328 -179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.686 ' HA ' HD12 ' A' ' 611' ' ' LEU . 7.9 m -62.67 -19.2 63.61 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.251 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -54.8 -34.14 62.36 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 120.982 0.42 . . . . 0.0 110.633 179.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -90.07 -35.69 15.32 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.396 179.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.686 HD12 ' HA ' ' A' ' 608' ' ' CYS . 7.5 mt -68.2 -30.09 69.1 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.85 179.766 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.544 HD13 ' CZ ' ' A' ' 569' ' ' PHE . 1.0 OUTLIER -58.28 151.41 19.54 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.086 -179.87 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.524 ' N ' HD23 ' A' ' 612' ' ' LEU . 11.6 p30 -80.09 127.02 31.81 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.858 179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -83.33 147.91 27.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.155 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -176.41 39.51 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.867 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.192 -0.909 . . . . 0.0 110.958 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.778 0.323 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.461 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 99.3 m-70 -58.4 134.75 56.9 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.933 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -76.72 61.77 1.9 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.139 0.495 . . . . 0.0 110.034 179.455 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.729 ' HE1' HG13 ' A' ' 602' ' ' VAL . 26.0 m-85 -62.13 121.77 13.9 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.583 -179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.489 ' HG2' HG22 ' A' ' 598' ' ' THR . 0.0 OUTLIER -120.64 152.87 37.63 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.81 -0.632 . . . . 0.0 110.167 179.417 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.3 t -62.37 105.32 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 120.976 0.417 . . . . 0.0 111.25 -179.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.496 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -123.11 130.01 52.21 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.299 179.75 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 7.1 m -91.98 119.97 32.19 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.857 0.36 . . . . 0.0 110.844 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.496 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -63.37 109.35 1.57 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.127 -179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 11.5 p -70.45 -26.05 63.47 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 121.124 0.487 . . . . 0.0 110.118 179.4 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.423 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 13.9 p -139.4 161.05 59.28 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.81 179.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.773 ' HB3' HD11 ' A' ' 586' ' ' LEU . 80.3 Cg_exo -44.35 111.14 0.25 Allowed 'Trans proline' 0 C--N 1.345 0.342 0 C-N-CA 122.339 2.026 . . . . 0.0 112.418 -179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.84 ' O ' HD12 ' A' ' 587' ' ' LEU . 87.5 m -125.72 135.33 51.97 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.035 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . 0.405 ' CE1' HD13 ' A' ' 586' ' ' LEU . 25.9 m-85 -88.41 156.03 19.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.159 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.428 ' O ' ' N ' ' A' ' 584' ' ' GLU . 37.3 t -85.26 126.06 33.39 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.873 179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.669 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -65.85 -11.41 46.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.207 179.802 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -91.53 -57.65 2.69 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 27.3 p -112.47 10.12 19.68 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 112.233 0.456 . . . . 0.0 112.233 -179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.428 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.8 mm-40 50.13 50.36 18.74 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.828 0.347 . . . . 0.0 110.914 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -122.52 120.64 4.37 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.971 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.773 HD11 ' HB3' ' A' ' 577' ' ' PRO . 14.4 tp -46.26 131.58 10.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.874 0.369 . . . . 0.0 111.415 179.644 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.84 HD12 ' O ' ' A' ' 578' ' ' THR . 2.4 mp -93.03 44.8 1.16 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.591 179.792 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -113.03 -165.45 0.99 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.002 -0.545 . . . . 0.0 110.832 -179.825 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.46 -75.15 0.21 Allowed Glycine 0 N--CA 1.451 -0.345 0 C-N-CA 120.745 -0.741 . . . . 0.0 112.466 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 2.7 mp -130.42 -61.09 0.88 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 CA-C-O 120.868 0.366 . . . . 0.0 111.065 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.45 90.37 4.05 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.249 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.9 OUTLIER -53.86 -21.65 8.12 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.196 179.647 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.547 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 10.2 tt0 -41.23 153.36 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.808 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.65 -171.53 33.74 Favored Glycine 0 C--N 1.331 0.299 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.551 179.939 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 64.4 mmm -122.05 144.72 48.74 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.432 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 15.9 ttt-85 -146.45 140.02 25.96 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.949 0.404 . . . . 0.0 111.277 -179.67 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.522 ' HB3' HG12 ' A' ' 602' ' ' VAL . 52.3 t -76.23 142.34 41.48 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.454 179.347 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.489 HG22 ' HG2' ' A' ' 570' ' ' GLU . 14.9 p -97.18 29.96 2.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.944 0.402 . . . . 0.0 110.699 -179.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -137.98 -42.01 0.53 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.993 -0.548 . . . . 0.0 111.024 -179.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 4.4 m -111.74 -18.4 12.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.135 -179.693 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 87.19 -2.83 86.93 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.58 -0.819 . . . . 0.0 112.65 -179.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.729 HG13 ' HE1' ' A' ' 569' ' ' PHE . 9.6 p -55.78 132.59 19.57 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.183 0 CA-C-O 120.724 0.297 . . . . 0.0 110.958 179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.469 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 0.7 OUTLIER -115.71 140.38 49.25 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.989 0.423 . . . . 0.0 110.936 -179.748 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.62 178.12 8.9 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.088 -179.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.613 ' CD2' HD23 ' A' ' 587' ' ' LEU . 36.6 m80 -75.63 176.57 7.53 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.32 179.38 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.21 -37.66 88.27 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.531 -0.304 . . . . 0.0 111.626 -179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -90.48 -41.52 11.38 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.951 0.405 . . . . 0.0 111.29 -179.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.593 ' HA ' HD12 ' A' ' 611' ' ' LEU . 13.2 m -56.96 -21.01 26.92 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -53.21 -35.98 60.49 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.832 0.349 . . . . 0.0 110.796 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -89.47 -35.42 15.99 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.552 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.593 HD12 ' HA ' ' A' ' 608' ' ' CYS . 6.7 mt -69.84 -28.1 65.4 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.055 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.586 HD23 ' N ' ' A' ' 613' ' ' ASN . 1.6 tt -57.8 155.56 10.11 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.318 -0.401 . . . . 0.0 111.059 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.586 ' N ' HD23 ' A' ' 612' ' ' LEU . 2.9 m-20 -79.87 132.31 36.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.762 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -89.64 146.37 24.59 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.129 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -176.93 39.8 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.886 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.249 1.072 0 CA-C-O 118.193 -0.908 . . . . 0.0 110.928 -179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.821 0.344 . . . . 0.0 111.142 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.449 ' CD2' ' HA ' ' A' ' 614' ' ' ALA . 97.2 m-70 -59.69 136.41 57.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.998 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.89 63.51 1.72 Allowed 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.102 0.477 . . . . 0.0 110.041 179.388 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.495 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 30.8 m-85 -61.42 120.83 11.24 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.825 -0.625 . . . . 0.0 111.503 -179.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -121.61 150.72 41.29 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.804 -0.634 . . . . 0.0 110.207 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 21.4 t -62.31 105.39 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-O 120.88 0.371 . . . . 0.0 111.049 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.776 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.4 OUTLIER -123.52 129.34 51.07 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.48 179.859 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.506 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.5 m -95.83 117.38 30.46 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 120.907 0.384 . . . . 0.0 110.606 179.427 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.776 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -64.48 111.07 2.52 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.244 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 22.3 p -69.8 -24.09 63.43 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.001 0.429 . . . . 0.0 110.238 179.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 34.9 p -136.87 159.43 70.19 Favored Pre-proline 0 C--N 1.33 -0.248 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.151 179.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.765 ' HB3' HD11 ' A' ' 586' ' ' LEU . 86.2 Cg_exo -46.02 112.11 0.41 Allowed 'Trans proline' 0 C--N 1.343 0.273 0 C-N-CA 122.48 2.12 . . . . 0.0 112.433 -179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.74 ' O ' HD12 ' A' ' 587' ' ' LEU . 52.0 m -129.2 135.45 48.85 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.92 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -84.75 156.04 21.6 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.229 -179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.519 ' O ' ' N ' ' A' ' 584' ' ' GLU . 50.0 t -86.73 121.4 29.19 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.779 179.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.637 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.2 OUTLIER -59.98 -17.07 35.5 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.234 179.947 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . 0.625 ' HB2' HD12 ' A' ' 612' ' ' LEU . 0.7 OUTLIER -84.85 -57.74 2.99 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.18 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 29.8 p -112.99 13.38 19.48 Favored 'General case' 0 C--N 1.331 -0.204 0 N-CA-C 112.07 0.396 . . . . 0.0 112.07 -179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.519 ' N ' ' O ' ' A' ' 580' ' ' CYS . 1.2 mt-10 46.77 49.62 14.03 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.818 0.342 . . . . 0.0 111.169 -179.975 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -124.19 124.73 5.57 Favored Glycine 0 N--CA 1.45 -0.406 0 C-N-CA 120.63 -0.795 . . . . 0.0 112.938 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.765 HD11 ' HB3' ' A' ' 577' ' ' PRO . 15.3 tp -46.2 134.47 8.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.854 0.359 . . . . 0.0 111.298 179.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.74 HD12 ' O ' ' A' ' 578' ' ' THR . 2.6 mp -94.11 39.3 1.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.93 -179.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.474 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.55 37.34 2.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.928 -179.914 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -99.15 84.8 0.65 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.795 -0.716 . . . . 0.0 112.364 179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 27.5 mt 68.63 -69.31 0.15 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-O 120.678 0.275 . . . . 0.0 111.199 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -93.95 92.25 7.28 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.932 0.396 . . . . 0.0 111.297 -179.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.474 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.3 OUTLIER -50.78 -23.53 2.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.958 -0.564 . . . . 0.0 111.137 179.556 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.506 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 0.1 OUTLIER -45.22 153.38 0.21 Allowed 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.48 -179.942 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -164.14 -172.54 31.74 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.874 -0.679 . . . . 0.0 112.514 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.495 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 71.9 mmm -121.18 144.58 48.51 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.65 0.262 . . . . 0.0 110.314 179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.43 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.1 ttt180 -146.68 141.21 26.59 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.992 0.425 . . . . 0.0 111.197 -179.774 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.522 ' HB3' HG12 ' A' ' 602' ' ' VAL . 52.6 t -76.83 144.31 39.16 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.478 179.393 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.6 p -98.96 30.85 3.21 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.955 0.407 . . . . 0.0 110.756 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -140.89 -40.37 0.4 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.178 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 9.8 m -109.49 -18.44 13.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.484 -0.325 . . . . 0.0 111.08 -179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.71 -5.67 84.35 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.579 -0.82 . . . . 0.0 112.632 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.637 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.4 p -54.69 142.63 8.36 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 CA-C-O 120.61 0.243 . . . . 0.0 111.073 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.478 ' HD2' ' CZ3' ' A' ' 572' ' ' TRP . 1.1 mttm -125.68 140.79 52.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.935 0.398 . . . . 0.0 110.799 179.802 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -148.71 177.92 9.09 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.078 -179.827 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.402 ' NE2' ' HG ' ' A' ' 587' ' ' LEU . 49.4 m80 -75.37 174.38 9.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.217 179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . 0.421 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 0.0 OUTLIER -65.02 -32.91 74.87 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.753 0.311 . . . . 0.0 111.235 -179.762 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . 0.519 ' HG2' HD11 ' A' ' 611' ' ' LEU . 33.3 tttm -90.7 -43.85 9.86 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.046 0.451 . . . . 0.0 111.076 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.839 ' HA ' HD12 ' A' ' 611' ' ' LEU . 50.9 m -60.34 -24.77 65.3 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.429 -179.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . 0.421 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -57.18 -28.4 62.77 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.84 0.352 . . . . 0.0 110.675 179.803 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 19.6 t0 -91.08 -31.35 16.3 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.448 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.839 HD12 ' HA ' ' A' ' 608' ' ' CYS . 3.4 mt -77.08 -30.9 55.68 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.103 -179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.625 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.2 tt -57.22 141.49 46.35 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.032 -179.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -60.5 -171.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.09 -0.504 . . . . 0.0 110.799 179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.449 ' HA ' ' CD2' ' A' ' 567' ' ' HIS . . . -134.59 140.25 45.96 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.19 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 1.6 t0 -156.0 39.48 0.37 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.78 -179.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.207 -0.901 . . . . 0.0 110.843 179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.692 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 6.0 tt0 . . . . . 0 N--CA 1.487 1.375 0 CA-C-O 120.88 0.372 . . . . 0.0 111.159 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.483 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.2 m-70 -58.64 131.49 51.0 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.004 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 5.0 t30 -77.65 62.44 2.56 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 121.074 0.464 . . . . 0.0 110.024 179.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.647 ' HE1' HG13 ' A' ' 602' ' ' VAL . 31.1 m-85 -61.48 124.53 20.9 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.714 -0.676 . . . . 0.0 111.492 -179.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -124.12 154.01 40.65 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.208 179.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 27.9 t -62.4 105.46 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-O 120.948 0.404 . . . . 0.0 111.149 -179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.503 ' CZ2' ' HA ' ' A' ' 574' ' ' ALA . 0.2 OUTLIER -122.95 134.34 54.35 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.313 179.691 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.521 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 4.0 m -96.5 121.18 38.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.899 0.381 . . . . 0.0 110.924 179.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.503 ' HA ' ' CZ2' ' A' ' 572' ' ' TRP . . . -66.3 109.41 2.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.131 -179.824 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 5.3 p -71.05 -25.83 62.82 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.092 0.472 . . . . 0.0 109.995 179.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.429 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 6.5 p -136.42 161.09 64.11 Favored Pre-proline 0 C--N 1.33 -0.245 0 CA-C-N 115.619 -0.718 . . . . 0.0 109.782 179.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.575 ' CB ' HD11 ' A' ' 586' ' ' LEU . 5.1 Cg_endo -47.71 110.48 0.32 Allowed 'Trans proline' 0 C--N 1.343 0.253 0 C-N-CA 122.504 2.136 . . . . 0.0 112.05 -179.969 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.809 ' O ' HD12 ' A' ' 587' ' ' LEU . 94.8 m -124.77 136.8 54.17 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.182 -179.805 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.7 m-85 -86.8 156.14 20.02 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.948 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.523 ' O ' ' N ' ' A' ' 584' ' ' GLU . 53.2 t -89.44 119.65 30.07 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.02 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.57 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -59.36 -18.2 36.45 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.388 179.876 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . 0.634 ' HB2' HD12 ' A' ' 612' ' ' LEU . 0.6 OUTLIER -83.32 -57.86 3.08 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.09 0.404 . . . . 0.0 112.09 -179.131 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 31.8 p -113.48 13.57 18.89 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 112.084 0.402 . . . . 0.0 112.084 -178.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.523 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.1 OUTLIER 46.9 51.57 12.52 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.808 0.337 . . . . 0.0 111.092 179.923 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.98 123.13 4.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.952 -179.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.575 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.1 tp -46.14 133.81 8.89 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.771 0.319 . . . . 0.0 111.445 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.809 HD12 ' O ' ' A' ' 578' ' ' THR . 2.8 mp -94.27 43.03 1.1 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.227 -0.442 . . . . 0.0 110.662 179.78 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.471 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.1 OUTLIER -111.86 -165.8 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.863 -179.778 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 109.83 -73.01 0.2 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.498 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 23.4 mt -133.77 -60.68 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.744 0.307 . . . . 0.0 111.114 -179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -101.88 90.27 3.93 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.93 0.395 . . . . 0.0 111.246 -179.988 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.471 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 2.8 ptt85 -54.17 -21.46 8.87 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.222 179.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.521 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 16.8 tt0 -41.35 155.82 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.779 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -171.31 -170.14 35.06 Favored Glycine 0 C--N 1.331 0.27 0 C-N-CA 120.872 -0.68 . . . . 0.0 112.584 179.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.435 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 62.9 mmm -122.28 145.99 47.71 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 110.429 -0.211 . . . . 0.0 110.429 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.415 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 9.5 ttt180 -146.53 141.87 27.46 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.987 0.422 . . . . 0.0 111.386 -179.674 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.568 ' HB3' HG12 ' A' ' 602' ' ' VAL . 48.6 t -79.12 140.41 37.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.831 -0.622 . . . . 0.0 110.201 179.207 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 69.7 p -97.27 30.92 2.63 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.005 0.431 . . . . 0.0 110.54 179.863 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -136.95 -40.86 0.6 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.22 -179.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 7.1 m -112.37 -22.24 10.98 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.272 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 94.08 -5.47 72.0 Favored Glycine 0 N--CA 1.45 -0.391 0 C-N-CA 120.512 -0.852 . . . . 0.0 112.734 -179.834 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.647 HG13 ' HE1' ' A' ' 569' ' ' PHE . 11.4 p -54.5 144.55 5.44 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.158 0 CA-C-O 120.685 0.278 . . . . 0.0 110.958 179.936 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.484 ' HD2' ' CH2' ' A' ' 572' ' ' TRP . 1.9 mttp -127.65 140.13 52.29 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.899 0.381 . . . . 0.0 110.727 179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 1.3 p -148.47 177.97 9.01 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.023 -179.706 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.479 ' CD2' HD23 ' A' ' 587' ' ' LEU . 45.2 m80 -75.06 -177.06 3.22 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.233 179.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . 0.409 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 2.9 tt0 -73.46 -35.66 65.76 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.464 -179.573 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -90.73 -34.73 15.25 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.948 0.404 . . . . 0.0 111.047 -179.891 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.581 ' HA ' HD12 ' A' ' 611' ' ' LEU . 27.6 m -67.57 -23.8 65.45 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.372 -179.678 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.0 OUTLIER -59.39 -28.51 66.96 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 120.886 0.374 . . . . 0.0 110.622 179.733 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -88.79 -33.43 17.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.328 179.395 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.581 HD12 ' HA ' ' A' ' 608' ' ' CYS . 5.9 mt -76.57 -30.16 56.93 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.088 179.902 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.634 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.6 tt -57.23 145.49 31.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.142 -179.696 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.512 ' N ' HD23 ' A' ' 612' ' ' LEU . 2.2 m120 -62.42 -174.26 0.06 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.82 179.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.692 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -149.81 143.14 25.17 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.037 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 3.5 t0 -165.45 39.92 0.07 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.912 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 1.1 m . . . . . 0 C--O 1.249 1.068 0 CA-C-O 118.162 -0.923 . . . . 0.0 110.937 179.963 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . 0.697 ' HA ' ' HB1' ' A' ' 614' ' ' ALA . 7.7 tt0 . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 120.842 0.353 . . . . 0.0 111.166 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.459 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 97.9 m-70 -58.99 140.72 55.38 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.902 179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -75.25 62.27 1.25 Allowed 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.127 0.489 . . . . 0.0 110.094 179.425 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.476 ' HB3' ' CE ' ' A' ' 595' ' ' MET . 29.8 m-85 -61.99 116.76 5.17 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.5 -179.338 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . 0.506 ' CD ' HG21 ' A' ' 598' ' ' THR . 45.6 mt-10 -116.96 151.39 36.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.279 179.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 30.1 t -62.49 105.38 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-O 120.969 0.414 . . . . 0.0 111.087 -179.647 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.551 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.1 OUTLIER -124.44 130.21 52.06 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.365 179.734 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.544 HG23 ' HA ' ' A' ' 593' ' ' GLN . 7.2 m -94.52 119.04 32.6 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 120.99 0.424 . . . . 0.0 110.764 179.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.551 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -62.93 110.42 1.77 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.934 -0.575 . . . . 0.0 111.117 -179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 9.7 p -71.94 -26.25 62.21 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.092 0.472 . . . . 0.0 109.965 179.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.404 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 43.3 p -136.03 159.46 70.97 Favored Pre-proline 0 N--CA 1.454 -0.243 0 CA-C-N 115.709 -0.678 . . . . 0.0 109.967 179.322 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.687 ' HB3' HD11 ' A' ' 586' ' ' LEU . 84.2 Cg_exo -45.38 111.39 0.31 Allowed 'Trans proline' 0 C--N 1.343 0.274 0 C-N-CA 122.45 2.1 . . . . 0.0 112.497 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.82 ' O ' HD12 ' A' ' 587' ' ' LEU . 92.7 m -127.28 138.39 53.06 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.06 -179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -89.01 156.09 19.08 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.061 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.496 ' O ' ' N ' ' A' ' 584' ' ' GLU . 43.2 t -88.25 122.33 31.66 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.231 -0.44 . . . . 0.0 110.973 179.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.611 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.1 OUTLIER -61.54 -16.39 47.29 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.269 179.717 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -84.17 -57.62 3.1 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 111.964 0.357 . . . . 0.0 111.964 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 23.3 p -116.04 16.03 16.09 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.096 0.406 . . . . 0.0 112.096 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.496 ' N ' ' O ' ' A' ' 580' ' ' CYS . 2.9 mp0 45.84 52.21 9.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.788 0.328 . . . . 0.0 111.247 179.864 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -125.36 122.86 4.76 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.585 -0.817 . . . . 0.0 113.071 -179.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.687 HD11 ' HB3' ' A' ' 577' ' ' PRO . 16.4 tp -46.35 135.92 7.7 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.896 0.379 . . . . 0.0 111.267 179.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.82 HD12 ' O ' ' A' ' 578' ' ' THR . 2.5 mp -95.43 39.88 1.12 Allowed 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.714 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.467 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -109.23 -167.81 1.26 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.779 -179.877 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . 110.54 -76.59 0.22 Allowed Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.776 -0.725 . . . . 0.0 112.548 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 36.6 mt -129.95 -61.14 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-O 120.729 0.3 . . . . 0.0 111.146 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -100.91 90.21 4.11 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.41 -179.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.467 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 0.8 OUTLIER -55.23 -21.42 14.01 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.03 -0.532 . . . . 0.0 111.191 179.67 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.544 ' HA ' HG23 ' A' ' 573' ' ' THR . 3.2 tt0 -42.99 153.82 0.08 Allowed 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.592 -179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -166.96 -168.67 29.49 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.792 -0.718 . . . . 0.0 112.796 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.476 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 65.7 mmm -125.79 144.1 50.78 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 110.362 -0.236 . . . . 0.0 110.362 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.413 ' CG ' ' HD3' ' A' ' 603' ' ' LYS . 9.5 ttt180 -146.66 141.09 26.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.036 0.446 . . . . 0.0 111.57 -179.725 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.52 ' HB3' HG12 ' A' ' 602' ' ' VAL . 42.5 t -79.0 144.24 34.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.771 -0.65 . . . . 0.0 110.228 178.894 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . 0.506 HG21 ' CD ' ' A' ' 570' ' ' GLU . 3.8 p -99.61 32.15 2.93 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 121.015 0.436 . . . . 0.0 110.569 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -139.25 -41.2 0.46 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.859 -0.61 . . . . 0.0 111.155 -179.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 5.9 m -110.68 -17.36 13.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.226 -179.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 86.49 -6.02 83.22 Favored Glycine 0 N--CA 1.45 -0.393 0 C-N-CA 120.578 -0.82 . . . . 0.0 112.657 -179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.611 HG23 ' CG ' ' A' ' 581' ' ' TYR . 14.3 p -54.53 142.49 8.36 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.174 0 CA-C-O 120.757 0.313 . . . . 0.0 111.068 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 572' ' ' TRP . 1.4 mttp -126.12 141.45 51.94 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.373 -0.376 . . . . 0.0 110.666 179.812 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . 0.47 ' HB3' HD12 ' A' ' 612' ' ' LEU . 2.1 p -148.32 178.05 8.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.073 -179.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.433 ' CD2' HD23 ' A' ' 587' ' ' LEU . 47.2 m80 -76.65 177.36 7.58 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.184 179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -59.1 -59.32 5.66 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.576 -179.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.01 -36.48 64.47 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.856 0.36 . . . . 0.0 111.597 -179.44 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . . . . . . . . . 50.8 m -57.77 -21.46 41.66 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.48 -179.538 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -55.32 -35.43 65.13 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-O 120.9 0.381 . . . . 0.0 110.801 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -87.18 -35.46 18.58 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.72 179.748 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . . . . . . . . . 17.8 mt -71.09 -29.43 65.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.057 179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.669 HD23 ' N ' ' A' ' 613' ' ' ASN . 3.1 tt -58.28 150.86 20.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.997 -179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.669 ' N ' HD23 ' A' ' 612' ' ' LEU . 37.2 m-20 -72.56 128.44 35.59 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.796 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . 0.697 ' HB1' ' HA ' ' A' ' 566' ' ' GLN . . . -90.24 147.11 23.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.103 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -168.98 39.45 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.842 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.25 1.107 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.927 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 120.867 0.365 . . . . 0.0 111.131 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' HIS . . . . . 0.437 ' HB2' ' CE2' ' A' ' 569' ' ' PHE . 96.7 m-70 -67.46 131.1 45.01 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.049 -179.897 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -75.21 64.32 1.44 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.178 0.513 . . . . 0.0 109.915 179.341 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' PHE . . . . . 0.56 ' HE1' HG13 ' A' ' 602' ' ' VAL . 23.1 m-85 -61.48 125.74 24.86 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.675 -179.021 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -128.39 153.81 46.68 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.219 179.482 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' VAL . . . . . . . . . . . . . 26.3 t -62.38 105.41 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-O 120.917 0.389 . . . . 0.0 111.147 -179.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' TRP . . . . . 0.874 ' CH2' ' HB2' ' A' ' 574' ' ' ALA . 0.5 OUTLIER -123.6 132.93 53.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.374 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' THR . . . . . 0.478 ' HA ' ' HA ' ' A' ' 593' ' ' GLN . 9.2 m -99.75 117.36 33.93 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.648 179.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' ALA . . . . . 0.874 ' HB2' ' CH2' ' A' ' 572' ' ' TRP . . . -65.82 118.25 9.38 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.319 -179.797 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' THR . . . . . . . . . . . . . 41.5 p -77.06 -26.51 53.6 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.168 0.509 . . . . 0.0 110.053 179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' THR . . . . . 0.452 ' HB ' ' HD2' ' A' ' 577' ' ' PRO . 64.1 p -131.95 157.93 76.88 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.593 -0.73 . . . . 0.0 109.912 179.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' PRO . . . . . 0.587 ' CB ' HD11 ' A' ' 586' ' ' LEU . 2.6 Cg_endo -45.85 111.37 0.33 Allowed 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 122.666 2.244 . . . . 0.0 112.193 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' THR . . . . . 0.628 ' O ' HD12 ' A' ' 587' ' ' LEU . 33.9 m -127.61 131.91 49.86 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.863 -179.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' TYR . . . . . . . . . . . . . 26.0 m-85 -82.99 156.09 23.61 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.151 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' CYS . . . . . 0.487 ' O ' ' N ' ' A' ' 584' ' ' GLU . 42.8 t -85.68 122.12 29.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.806 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' TYR . . . . . 0.572 ' CG ' HG23 ' A' ' 602' ' ' VAL . 0.3 OUTLIER -62.43 -13.96 35.53 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.395 179.995 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' GLU . . . . . 0.683 ' HB2' HD12 ' A' ' 612' ' ' LEU . 0.6 OUTLIER -89.09 -57.64 2.83 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.351 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' CYS . . . . . . . . . . . . . 28.5 p -108.4 4.94 24.93 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 112.191 0.441 . . . . 0.0 112.191 -179.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' GLU . . . . . 0.487 ' N ' ' O ' ' A' ' 580' ' ' CYS . 0.8 OUTLIER 53.93 48.94 20.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.8 0.333 . . . . 0.0 110.893 -179.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . -126.57 126.09 5.6 Favored Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.636 -0.793 . . . . 0.0 112.949 -179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' LEU . . . . . 0.587 HD11 ' CB ' ' A' ' 577' ' ' PRO . 15.0 tp -46.31 134.42 8.83 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.934 0.397 . . . . 0.0 111.234 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 587' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 578' ' ' THR . 0.9 OUTLIER -94.53 39.62 1.09 Allowed 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.802 179.921 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 588' ' ' TRP . . . . . 0.465 ' CZ3' ' CB ' ' A' ' 592' ' ' ARG . 0.0 OUTLIER -108.32 30.15 6.69 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.995 -179.882 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 589' ' ' GLY . . . . . . . . . . . . . . . -88.22 81.16 1.6 Allowed Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.77 -0.729 . . . . 0.0 112.26 179.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 590' ' ' ILE . . . . . . . . . . . . . 7.9 mt 68.68 -68.93 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-O 120.735 0.303 . . . . 0.0 111.086 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 591' ' ' ALA . . . . . . . . . . . . . . . -91.54 93.2 8.85 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.919 0.39 . . . . 0.0 111.134 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 592' ' ' ARG . . . . . 0.465 ' CB ' ' CZ3' ' A' ' 588' ' ' TRP . 8.1 ptt180 -51.87 -22.97 4.21 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.306 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 593' ' ' GLN . . . . . 0.478 ' HA ' ' HA ' ' A' ' 573' ' ' THR . 34.4 tt0 -45.62 154.76 0.19 Allowed 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.397 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 594' ' ' GLY . . . . . . . . . . . . . . . -167.45 -163.62 21.65 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.699 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 595' ' ' MET . . . . . 0.462 ' CE ' ' HB3' ' A' ' 569' ' ' PHE . 69.3 mmm -126.79 144.99 50.79 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 110.353 -0.239 . . . . 0.0 110.353 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 596' ' ' ARG . . . . . 0.439 ' HA ' ' O ' ' A' ' 602' ' ' VAL . 0.2 OUTLIER -145.63 141.78 28.46 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.974 0.416 . . . . 0.0 111.228 -179.65 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 597' ' ' CYS . . . . . 0.575 ' HB3' HG12 ' A' ' 602' ' ' VAL . 50.5 t -78.92 142.21 36.93 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.237 179.253 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 598' ' ' THR . . . . . . . . . . . . . 24.9 p -98.38 31.32 2.85 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 120.992 0.425 . . . . 0.0 110.564 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 599' ' ' GLU . . . . . . . . . . . . . 4.9 mm-40 -139.42 -40.76 0.46 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.224 -179.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 600' ' ' CYS . . . . . . . . . . . . . 6.0 m -112.41 -21.21 11.48 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.253 -179.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 601' ' ' GLY . . . . . . . . . . . . . . . 92.41 -4.6 76.98 Favored Glycine 0 N--CA 1.45 -0.429 0 C-N-CA 120.595 -0.812 . . . . 0.0 112.623 -179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 602' ' ' VAL . . . . . 0.575 HG12 ' HB3' ' A' ' 597' ' ' CYS . 8.0 p -54.41 140.84 11.06 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.144 0 CA-C-O 120.632 0.253 . . . . 0.0 110.876 179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 603' ' ' LYS . . . . . 0.455 ' HD2' ' CE2' ' A' ' 572' ' ' TRP . 1.0 OUTLIER -124.88 139.82 53.48 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.856 179.965 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 604' ' ' CYS . . . . . . . . . . . . . 0.2 OUTLIER -148.71 177.88 9.13 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.066 -179.796 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 605' ' ' HIS . . . . . 0.578 ' CD2' HD23 ' A' ' 587' ' ' LEU . 54.3 m80 -75.86 177.73 6.74 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.283 179.453 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 606' ' ' GLU . . . . . 0.415 ' O ' ' HG2' ' A' ' 609' ' ' GLN . 1.8 tt0 -67.48 -35.23 78.76 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.555 -0.293 . . . . 0.0 111.285 -179.655 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 607' ' ' LYS . . . . . . . . . . . . . 26.7 mttt -90.85 -47.32 7.68 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 121.087 0.47 . . . . 0.0 111.039 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 608' ' ' CYS . . . . . 0.528 ' HA ' HD12 ' A' ' 611' ' ' LEU . 91.0 m -59.44 -22.35 61.37 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.497 -179.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 609' ' ' GLN . . . . . 0.415 ' HG2' ' O ' ' A' ' 606' ' ' GLU . 0.3 OUTLIER -57.8 -31.09 66.23 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.866 0.365 . . . . 0.0 110.434 179.746 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 610' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -89.28 -30.46 18.45 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.393 179.455 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 611' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 608' ' ' CYS . 13.9 mt -75.9 -27.97 57.88 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.133 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 612' ' ' LEU . . . . . 0.683 HD12 ' HB2' ' A' ' 582' ' ' GLU . 1.8 tt -54.5 145.49 18.4 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.271 -179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 613' ' ' ASN . . . . . 0.411 ' O ' HD23 ' A' ' 612' ' ' LEU . 2.9 m-20 -78.57 126.18 30.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.824 179.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 614' ' ' ALA . . . . . . . . . . . . . . . -68.16 150.37 48.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.087 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 615' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -172.38 39.89 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.858 179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 616' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.328 -0.844 . . . . 0.0 110.879 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 701' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 702' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_